![3-[(Ethylamino)carbonyl]aminobenzoic acid structure](/static/products/2375/23754-39-4.webp)
3-[(Ethylamino)carbonyl]aminobenzoic acid
TL;DR: 3-[(Ethylamino)carbonyl]aminobenzoic acid (CAS 23754-39-4) is a chemical compound with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(ethylcarbamoylamino)benzoic acid
Also Known As: 3-[(ethylamino)carbonyl]aminobenzoic acid, 3-(3-Ethylureido)benzoic acid, 3-(ethylcarbamoylamino)benzoic acid, 3-[(ethylcarbamoyl)amino]benzoic acid, m-(3-Ethylureido)benzoic acid
| Molecular Formula | C10H12N2O3 |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.0848 |
| Heavy Atoms | 15 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 23754-39-4 |
|---|---|
| SMILES | CCNC(=O)NC1=CC=CC(=C1)C(=O)O |
| InChIKey | SBLVYUXXTSKRNY-UHFFFAOYSA-N |
Product Overview
3-[(Ethylamino)carbonyl]aminobenzoic acid (CAS 23754-39-4), with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol. IUPAC: 3-(ethylcarbamoylamino)benzoic acid.
Chemical Property Profile of 3-[(Ethylamino)carbonyl]aminobenzoic acid
Property Insights of 3-[(Ethylamino)carbonyl]aminobenzoic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Ethylamino)carbonyl]aminobenzoic acid. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Ethylamino)carbonyl]aminobenzoic acid. Following Lipinski's Rule of Five, 3-[(Ethylamino)carbonyl]aminobenzoic 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 3-[(Ethylamino)carbonyl]aminobenzoic acid?
The CAS number of 3-[(Ethylamino)carbonyl]aminobenzoic acid is 23754-39-4.
What is the molecular formula of 3-[(Ethylamino)carbonyl]aminobenzoic acid?
The molecular formula of 3-[(Ethylamino)carbonyl]aminobenzoic acid is C10H12N2O3.
What is the molecular weight of 3-[(Ethylamino)carbonyl]aminobenzoic acid?
The molecular weight of 3-[(Ethylamino)carbonyl]aminobenzoic acid is 208.08 g/mol.
Where can I buy 3-[(Ethylamino)carbonyl]aminobenzoic acid?
You can request a quote for 3-[(Ethylamino)carbonyl]aminobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Ethylamino)carbonyl]aminobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Ethylamino)carbonyl]aminobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.