Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-
TL;DR: Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)- (CAS 76267-01-1) is a chemical compound with molecular formula C11H13N3O4 and molecular weight 251.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[methyl(methylcarbamoyl)carbamoyl]amino]benzoic acid
Also Known As: 2-[(methyl- amino]benzoicacid, 1,3-Dimethyl-5-(2-carboxyphenyl)biuret, Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-, 2-(((Methyl((methylamino)carbonyl)amino)carbonyl)amino)benzoic acid, 2-[(methyl-(methylcarbamoyl)carbamoyl)amino]benzoic acid
| Molecular Formula | C11H13N3O4 |
|---|---|
| Molecular Weight | 251.09 g/mol |
| LogP | 1.1879 |
| Topological Polar Surface Area | 98.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.0906 |
| Heavy Atoms | 18 |
| Complexity | 486.9316 |
Chemical Identifiers
| CAS Number | 76267-01-1 |
|---|---|
| SMILES | CNC(=O)N(C)C(=O)NC1=CC=CC=C1C(=O)O |
Product Overview
Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)- (CAS 76267-01-1), with molecular formula C11H13N3O4 and molecular weight 251.09 g/mol. IUPAC: 2-[[methyl(methylcarbamoyl)carbamoyl]amino]benzoic acid.
Chemical Property Profile of Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-
Property Insights of Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-
The XLogP value of 1.1879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-. The TPSA of 98.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-. Following Lipinski's Rule of Five, Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)- 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 Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-?
The CAS number of Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)- is 76267-01-1.
What is the molecular formula of Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-?
The molecular formula of Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)- is C11H13N3O4.
What is the molecular weight of Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-?
The molecular weight of Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)- is 251.09 g/mol.
Where can I buy Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-?
You can request a quote for Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-(((methyl((methylamino)carbonyl)amino)carbonyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.