![2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid structure](/static/products/890/890957-77-4.png)
2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid
TL;DR: 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid (CAS 890957-77-4) is a chemical compound with molecular formula C17H17NO5 and molecular weight 315.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dimethoxybenzoyl)amino]-5-methylbenzoic acid
Also Known As: 2-[(3,4-dimethoxybenzoyl)amino]-5-methylbenzoic acid, 2-(3,4-DIMETHOXYBENZAMIDO)-5-METHYLBENZOIC ACID, 2-[(3,4-dimethoxybenzoyl)amino]-5-methyl-benzoic Acid, 2-{[(3,4-dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid
| Molecular Formula | C17H17NO5 |
|---|---|
| Molecular Weight | 315.11 g/mol |
| LogP | 2.96272 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.1107 |
| Heavy Atoms | 23 |
| Complexity | 754.6441 |
Chemical Identifiers
| CAS Number | 890957-77-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)OC)C(=O)O |
Product Overview
2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid (CAS 890957-77-4), with molecular formula C17H17NO5 and molecular weight 315.11 g/mol. IUPAC: 2-[(3,4-dimethoxybenzoyl)amino]-5-methylbenzoic acid.
Chemical Property Profile of 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid
Property Insights of 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid
The XLogP value of 2.96272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid. Following Lipinski's Rule of Five, 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid has 2 hydrogen bond donor(s) and 4 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 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid?
The CAS number of 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid is 890957-77-4.
What is the molecular formula of 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid?
The molecular formula of 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid is C17H17NO5.
What is the molecular weight of 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid?
The molecular weight of 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid is 315.11 g/mol.
Where can I buy 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid?
You can request a quote for 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(3,4-Dimethoxyphenyl)carbonyl]amino}-5-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.