cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid
TL;DR: cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid (CAS 194874-82-3) is a chemical compound with molecular formula C15H19NO3 and molecular weight 261.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid
Also Known As: 2-Benzylcarbamoyl-cyclohexanecarboxylic acid, (2R)-2-(benzylcarbamoyl)cyclohexanecarboxylic acid, (1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid
| Molecular Formula | C15H19NO3 |
|---|---|
| Molecular Weight | 261.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.1365 |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 194874-82-3 |
|---|---|
| SMILES | C1CC[C@H]([C@H](C1)C(=O)NCC2=CC=CC=C2)C(=O)O |
| InChIKey | NCAZRKFIGJVHLN-QWHCGFSZSA-N |
Product Overview
cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid (CAS 194874-82-3), with molecular formula C15H19NO3 and molecular weight 261.14 g/mol. IUPAC: cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid.
Chemical Property Profile of cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid
Property Insights of cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid. Following Lipinski's Rule of Five, cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid?
The CAS number of cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid is 194874-82-3.
What is the molecular formula of cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid?
The molecular formula of cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid is C15H19NO3.
What is the molecular weight of cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid?
The molecular weight of cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid is 261.14 g/mol.
Where can I buy cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid?
You can request a quote for cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for cis-(1R,2S)-2-(benzylcarbamoyl)cyclohexane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.