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Screening compounds

Hepzidine maleate

Also known as 4-((10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-1-methylpiperidide hydrogen maleate, 4-[(10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)oxy]-1-methylpiperidide hydrogen maleate, BS 7051

CAS 1057-81-4Formula C25H29NO5Molar mass 423.51 g/mol
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Hepzidine maleate chemical structure, C25H29NO5, CAS 1057-81-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1057-81-4
Formula
C25H29NO5
Molar mass
423.51 g/mol
HS code
293339
Category
Screening compounds

What is Hepzidine maleate?

Plain description, key identifiers and synonyms

Hepzidine maleate is a chemical substance with the molecular formula C25H29NO5 and a molar mass of 423.51 g/mol. Its CAS registry number is 1057-81-4. The IUPAC name is (Z)-but-2-enedioic acid, 1-methyl-4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxy)piperidine.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(Z)-but-2-enedioic acid, 1-methyl-4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxy)piperidine
CAS number
1057-81-4
Molecular formula
C25H29NO5
UNII
55F8T2B2CH
InChIKey
QIFFMXMEBPAKMS-BTJKTKAUSA-N
InChI
InChI=1S/C21H25NO.C4H4O4/c1-22-14-12-18(13-15-22)23-21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21;5-3(6)1-2-4(7)8/h2-9,18,21H,10-15H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
Canonical SMILES
CN1CCC(OC2c3ccccc3CCc3ccccc32)CC1.O=C(O)C=CC(=O)O
Isomeric SMILES
CN1CCC(CC1)OC2C3=CC=CC=C3CCC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O

Synonyms

  • 4-((10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-1-methylpiperidide hydrogen maleate
  • 4-[(10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)oxy]-1-methylpiperidide hydrogen maleate
  • BS 7051
  • 4-((10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-1-methylpiperidine, maleate (1:1)
  • Piperidine, 4-((10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-1-methyl-, (Z)-butenedioate (1:1)
  • Piperidine, 4-((10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-1-methyl-, maleate (1:1)
  • 4-[(10,d]cyclohepten-5-yl)oxy]-1-methylpiperidide hydrogen maleate
  • 4-[(10,d]cyclohepten-5-yl)oxy]-1-methylpiperidine maleate (1:1)
  • Piperidine,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)oxy]-1-methyl-, maleate (1:1)
  • Piperidine, 4-[(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)oxy]-1-methyl-, (Z)-2-butenedioate (1:1)
  • Piperidine,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)oxy]-1-methyl-, (Z)-butenedioate (1:1)

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
423.51 g/molcalc.
Exact mass
423.2046 Dacalc.
LogP (octanol/water)
3.7calc.
Topological polar surface area
87.07 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
4calc.
Heavy atoms
31calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.36calc.
Formal charge
0calc.
Stereocentres
0calc.
Components
2calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccc2c(c1)CCc1ccccc1C2OC1CCNCC1

c1ccc2c(c1)CCc1ccccc1C2OC1CCNCC1

4 rings, 22 atoms.

5 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Hepzidine maleate suppliers

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Hepzidine maleate price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Hepzidine maleate is traded under.

HS 2933.39Indicative HS code

Heterocyclic compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure…

World exports in 2024
$9.16B
−17.9% vs 2023, imports $10.6B
2019 to 2024
Top exporters
  1. China21.5%
  2. India * partner reported12.3%
  3. Ireland11.6%
Top importers
  1. Germany14.2%
  2. United States12.8%
  3. Brazil10.1%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Hepzidine maleate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Hepzidine maleate, based on the data on this page

What is Hepzidine maleate?

Hepzidine maleate is a chemical substance with the molecular formula C25H29NO5 and a molar mass of 423.51 g/mol. Its CAS registry number is 1057-81-4. The IUPAC name is (Z)-but-2-enedioic acid, 1-methyl-4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxy)piperidine.

What is the CAS number of Hepzidine maleate?

The CAS registry number of Hepzidine maleate is 1057-81-4.

What is the molecular formula and weight of Hepzidine maleate?

The molecular formula of Hepzidine maleate is C25H29NO5 and its molar mass is 423.51 g/mol.

What is Hepzidine maleate used for?

Known uses and roles of Hepzidine maleate include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Hepzidine maleate hazardous?

No GHS hazard classification for Hepzidine maleate is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Hepzidine maleate?

Hepzidine maleate is usually classified under HS code 293339 (Compounds containing an unfused pyridine ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Hepzidine maleate?

Post a free request on CompoundList and suppliers of Hepzidine maleate will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Hepzidine maleate?

Suppliers quote Hepzidine maleate on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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