Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-
TL;DR: Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro- (CAS 60971-94-0) is a chemical compound with molecular formula C8H7ClN2O3 and molecular weight 214.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(carbamoylamino)-2-chlorobenzoic acid
Also Known As: 2-chloro-4-ureidobenzoic acid, Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-, 4-(carbamoylamino)-2-chlorobenzoic acid
| Molecular Formula | C8H7ClN2O3 |
|---|---|
| Molecular Weight | 214.01 g/mol |
| LogP | 1.5288 |
| Topological Polar Surface Area | 92.42 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.01453 |
| Heavy Atoms | 14 |
| Complexity | 392.17282 |
Chemical Identifiers
| CAS Number | 60971-94-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)N)Cl)C(=O)O |
Product Overview
Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro- (CAS 60971-94-0), with molecular formula C8H7ClN2O3 and molecular weight 214.01 g/mol. IUPAC: 4-(carbamoylamino)-2-chlorobenzoic acid.
Chemical Property Profile of Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-
Property Insights of Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-
The XLogP value of 1.5288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-. The TPSA of 92.42 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-. Following Lipinski's Rule of Five, Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro- has 3 hydrogen bond donor(s) and 2 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, 4-((aminocarbonyl)amino)-2-chloro-?
The CAS number of Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro- is 60971-94-0.
What is the molecular formula of Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-?
The molecular formula of Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro- is C8H7ClN2O3.
What is the molecular weight of Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-?
The molecular weight of Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro- is 214.01 g/mol.
Where can I buy Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-?
You can request a quote for Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-((aminocarbonyl)amino)-2-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.