![4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester structure](/static/products/3025/302573-54-2.webp)
4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester
TL;DR: 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester (CAS 302573-54-2) is a chemical compound with molecular formula C20H17NO5 and molecular weight 351.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-[(2-oxochromene-3-carbonyl)amino]benzoate
Also Known As: BAS 01220011, AB01294412-01, 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester, isopropyl 4-(2-oxo-2H-chromene-3-carboxamido)benzoate, methylethyl 4-[(2-oxochromen-3-yl)carbonylamino]benzoate
| Molecular Formula | C20H17NO5 |
|---|---|
| Molecular Weight | 351.11 g/mol |
| LogP | 3.6105 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.1107 |
| Heavy Atoms | 26 |
| Complexity | 1018.301 |
Chemical Identifiers
| CAS Number | 302573-54-2 |
|---|---|
| SMILES | CC(C)OC(=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 isopropyl ester (CAS 302573-54-2), with molecular formula C20H17NO5 and molecular weight 351.11 g/mol. IUPAC: propan-2-yl 4-[(2-oxochromene-3-carbonyl)amino]benzoate.
Chemical Property Profile of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester
Property Insights of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester
The XLogP value of 3.6105 indicates that 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester. Following Lipinski's Rule of Five, 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester has 1 hydrogen bond donor(s) and 5 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 isopropyl ester?
The CAS number of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester is 302573-54-2.
What is the molecular formula of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester?
The molecular formula of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester is C20H17NO5.
What is the molecular weight of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester?
The molecular weight of 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester is 351.11 g/mol.
Where can I buy 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester?
You can request a quote for 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl 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 isopropyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-Oxo-2H-chromene-3-carbonyl)-amino]-benzoic acid isopropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.