cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate
TL;DR: cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate (CAS 26693-55-0) is a chemical compound with molecular formula C14H16NO3- and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate
Also Known As: (-)-cis-2-Benzamidocyclohexanecarboxylic Acid, I14-4012
| Molecular Formula | C14H16NO3- |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 0.7251 |
| Topological Polar Surface Area | 69.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.11302 |
| Heavy Atoms | 18 |
| Complexity | 429.92505 |
Chemical Identifiers
| CAS Number | 26693-55-0 |
|---|---|
| SMILES | C1CC[C@@H]([C@@H](C1)C(=O)[O-])NC(=O)C2=CC=CC=C2 |
Product Overview
cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate (CAS 26693-55-0), with molecular formula C14H16NO3- and molecular weight 246.11 g/mol. IUPAC: cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate.
Chemical Property Profile of cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate
Property Insights of cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate
The XLogP value of 0.7251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate. The TPSA of 69.23 Ų falls within the moderate polarity range, balancing permeability and solubility for cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate. Following Lipinski's Rule of Five, cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate has 1 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-benzamidocyclohexane-1-carboxylate?
The CAS number of cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate is 26693-55-0.
What is the molecular formula of cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate?
The molecular formula of cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate is C14H16NO3-.
What is the molecular weight of cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate?
The molecular weight of cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate is 246.11 g/mol.
Where can I buy cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate?
You can request a quote for cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate 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-benzamidocyclohexane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for cis-(1R,2S)-2-benzamidocyclohexane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.