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Screening compounds

Communesin E

CAS 727416-58-2Formula C28H32N4OMolar mass 440.59 g/mol
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Communesin E chemical structure, C28H32N4O, CAS 727416-58-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
727416-58-2
Formula
C28H32N4O
Molar mass
440.59 g/mol
HS code
293399
Category
Screening compounds

What is Communesin E?

Plain description, key identifiers and synonyms

Communesin E is a pyridoindole.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-[(2R,6S,14S,22S,25S)-15-methyl-25-(2-methylprop-1-enyl)-1,3,13,15-tetrazaheptacyclo[18.4.1.02,6.06,22.07,12.014,22.016,21]pentacosa-7,9,11,16,18,20-hexaen-3-yl]ethanone
CAS number
727416-58-2
Molecular formula
C28H32N4O
InChIKey
AJKLOOXVDIANRY-GRPMBEMWSA-N
InChI
InChI=1S/C28H32N4O/c1-17(2)16-23-19-8-7-11-22-24(19)28-13-15-32(23)26-27(28,12-14-31(26)18(3)33)20-9-5-6-10-21(20)29-25(28)30(22)4/h5-11,16,23,25-26,29H,12-15H2,1-4H3/t23-,25-,26-,27+,28+/m0/s1
Canonical SMILES
CC(=O)N1CCC23c4ccccc4NC4N(C)c5cccc6c5C42CCN(C6C=C(C)C)C13
Isomeric SMILES
CC(=C[C@H]1C2=C3C(=CC=C2)N([C@H]4[C@@]35CCN1[C@H]6[C@@]5(CCN6C(=O)C)C7=CC=CC=C7N4)C)C

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
440.59 g/molcalc.
Exact mass
440.2576 Dacalc.
LogP (octanol/water)
4.37calc.
Topological polar surface area
38.82 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
1calc.
Heavy atoms
33calc.
Rings
8calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.46calc.
Formal charge
0calc.
Stereocentres
6calc.
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)NC1Nc3cccc4c3C13CCN(C4)C1NCCC213

c1ccc2c(c1)NC1Nc3cccc4c3C13CCN(C4)C1NCCC213

8 rings, 25 atoms.

1 other chemical 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.

Communesin E suppliers

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Communesin E 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 Communesin E is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Communesin E, based on the data on this page

What is Communesin E?

Communesin E is a pyridoindole.

What is the CAS number of Communesin E?

The CAS registry number of Communesin E is 727416-58-2.

What is the molecular formula and weight of Communesin E?

The molecular formula of Communesin E is C28H32N4O and its molar mass is 440.59 g/mol.

What is Communesin E used for?

Known uses and roles of Communesin E include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Communesin E hazardous?

No GHS hazard classification for Communesin E 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 Communesin E?

Communesin E is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Communesin E?

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

What is the price of Communesin E?

Suppliers quote Communesin E 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

Practical guides that help when you source, ship or handle Communesin E

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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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