![5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid structure](/static/products/7142/714209-46-8.webp)
5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid
TL;DR: 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid (CAS 714209-46-8) is a chemical compound with molecular formula C15H14ClNO5 and molecular weight 323.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(6-carboxycyclohex-3-ene-1-carbonyl)amino]-2-chlorobenzoic acid
Also Known As: CBKinase1_009848, CBKinase1_022248, BRD-A33459891-001-01-6, 5-(6-carboxycyclohex-3-enecarboxamido)-2-chlorobenzoic acid, 5-[(6-carboxycyclohex-3-ene-1-carbonyl)amino]-2-chlorobenzoic acid
| Molecular Formula | C15H14ClNO5 |
|---|---|
| Molecular Weight | 323.06 g/mol |
| LogP | 2.6437 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.05606 |
| Heavy Atoms | 22 |
| Complexity | 655.33295 |
Chemical Identifiers
| CAS Number | 714209-46-8 |
|---|---|
| SMILES | C1C=CCC(C1C(=O)NC2=CC(=C(C=C2)Cl)C(=O)O)C(=O)O |
Product Overview
5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid (CAS 714209-46-8), with molecular formula C15H14ClNO5 and molecular weight 323.06 g/mol. IUPAC: 5-[(6-carboxycyclohex-3-ene-1-carbonyl)amino]-2-chlorobenzoic acid.
Chemical Property Profile of 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid
Property Insights of 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid
The XLogP value of 2.6437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid. Following Lipinski's Rule of Five, 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid has 3 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 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid?
The CAS number of 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid is 714209-46-8.
What is the molecular formula of 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid?
The molecular formula of 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid is C15H14ClNO5.
What is the molecular weight of 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid?
The molecular weight of 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid is 323.06 g/mol.
Where can I buy 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid?
You can request a quote for 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-{[(6-Carboxycyclohex-3-en-1-yl)carbonyl]amino}-2-chlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.