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Screening compounds

Tch-013

Also known as (4R,5R)-1-Benzyl-2,4,5-triphenyl-4,5-dihydro-1H-imidazole-4-carboxylic acid ethyl ester, Phenyl (4R,5R)-1-benzyl-3-ethyl-2,5-diphenylimidazolidine-4-carboxylate

CAS 1132091-17-8Formula C31H30N2O2Molar mass 462.59 g/mol
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Tch-013 chemical structure, C31H30N2O2, CAS 1132091-17-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1132091-17-8
Formula
C31H30N2O2
Molar mass
462.59 g/mol
HS code
293329
Category
Screening compounds

What is Tch-013?

Plain description, key identifiers and synonyms

Tch-013 is a chemical substance with the molecular formula C31H30N2O2 and a molar mass of 462.59 g/mol. Its CAS registry number is 1132091-17-8. The IUPAC name is phenyl (4R,5R)-1-benzyl-3-ethyl-2,5-diphenylimidazolidine-4-carboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
phenyl (4R,5R)-1-benzyl-3-ethyl-2,5-diphenylimidazolidine-4-carboxylate
CAS number
1132091-17-8
Molecular formula
C31H30N2O2
InChIKey
XNGZTFZUVIAPCL-HPSQJEMFSA-N
InChI
InChI=1S/C31H30N2O2/c1-2-32-29(31(34)35-27-21-13-6-14-22-27)28(25-17-9-4-10-18-25)33(23-24-15-7-3-8-16-24)30(32)26-19-11-5-12-20-26/h3-22,28-30H,2,23H2,1H3/t28-,29-,30?/m1/s1
Canonical SMILES
CCN1C(C(=O)Oc2ccccc2)C(c2ccccc2)N(Cc2ccccc2)C1c1ccccc1
Isomeric SMILES
CCN1[C@H]([C@H](N(C1C2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC5=CC=CC=C5

Synonyms

  • (4R,5R)-1-Benzyl-2,4,5-triphenyl-4,5-dihydro-1H-imidazole-4-carboxylic acid ethyl ester
  • Phenyl (4R,5R)-1-benzyl-3-ethyl-2,5-diphenylimidazolidine-4-carboxylate

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
462.59 g/molcalc.
Exact mass
462.2307 Dacalc.
LogP (octanol/water)
6.24calc.
Topological polar surface area
32.78 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
7calc.
Heavy atoms
35calc.
Rings
5calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.19calc.
Formal charge
0calc.
Stereocentres
3calc.
Lipinski rule of five
Passes (1 violation)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, O=C(Oc1ccccc1)C1NC(c2ccccc2)N(Cc2ccccc2)C1c1ccccc1

O=C(Oc1ccccc1)C1NC(c2ccccc2)N(Cc2ccccc2)C1c1ccccc1

5 rings, 33 atoms.

No other chemical in our database has 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.

Tch-013 suppliers

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Tch-013 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 Tch-013 is traded under.

HS 2933.29Indicative HS code

Compounds containing an unfused imidazole ring (whether or not hydrogenated) in the…

World exports in 2024
$1.43B
−7.6% vs 2023, imports $1.47B
2019 to 2024
Top exporters
  1. China28.1%
  2. France * partner reported12.7%
  3. India * partner reported10.3%
Top importers
  1. United Kingdom13.0%
  2. United States7.9%
  3. China6.5%

* Partner reported figures, a lower bound.

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

The HS code shown for Tch-013 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Tch-013, based on the data on this page

What is Tch-013?

Tch-013 is a chemical substance with the molecular formula C31H30N2O2 and a molar mass of 462.59 g/mol. Its CAS registry number is 1132091-17-8. The IUPAC name is phenyl (4R,5R)-1-benzyl-3-ethyl-2,5-diphenylimidazolidine-4-carboxylate.

What is the CAS number of Tch-013?

The CAS registry number of Tch-013 is 1132091-17-8.

What is the molecular formula and weight of Tch-013?

The molecular formula of Tch-013 is C31H30N2O2 and its molar mass is 462.59 g/mol.

What is Tch-013 used for?

Known uses and roles of Tch-013 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Tch-013 hazardous?

No GHS hazard classification for Tch-013 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 Tch-013?

Tch-013 is usually classified under HS code 293329 (Compounds containing an unfused imidazole ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Tch-013?

Post a free request on CompoundList and suppliers of Tch-013 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Tch-013?

Suppliers quote Tch-013 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 Tch-013

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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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