4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester
TL;DR: 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester (CAS 301689-33-8) is a chemical compound with molecular formula C20H17NO6 and molecular weight 367.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 4-[(2-oxochromene-3-carbonyl)amino]benzoate
Also Known As: DivK1c_005687, CDS1_004647, BAS 05203723, BIM-0030284.P001, 2-methoxyethyl 4-(2-oxo-2H-chromene-3-carboxamido)benzoate
| Molecular Formula | C20H17NO6 |
|---|---|
| Molecular Weight | 367.11 g/mol |
| LogP | 2.8485 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.1056 |
| Heavy Atoms | 27 |
| Complexity | 1022.5714 |
Chemical Identifiers
| CAS Number | 301689-33-8 |
|---|---|
| SMILES | COCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3OC2=O |
Product Overview
4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester (CAS 301689-33-8), with molecular formula C20H17NO6 and molecular weight 367.11 g/mol. IUPAC: 2-methoxyethyl 4-[(2-oxochromene-3-carbonyl)amino]benzoate.
Chemical Property Profile of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester
Property Insights of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester
The XLogP value of 2.8485 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester. Following Lipinski's Rule of Five, 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester has 1 hydrogen bond donor(s) and 6 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 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester?
The CAS number of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester is 301689-33-8.
What is the molecular formula of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester?
The molecular formula of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester is C20H17NO6.
What is the molecular weight of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester?
The molecular weight of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester is 367.11 g/mol.
Where can I buy 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester?
You can request a quote for 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid 2-methoxy-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.