![3-[(Dimethylcarbamoyl)amino]benzoic acid structure](/static/products/896/896160-52-4.png)
3-[(Dimethylcarbamoyl)amino]benzoic acid
TL;DR: 3-[(Dimethylcarbamoyl)amino]benzoic acid (CAS 896160-52-4) is a chemical compound with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylcarbamoylamino)benzoic acid
Also Known As: 3-(3,3-Dimethylureido)benzoic acid, 3-[(dimethylcarbamoyl)amino]benzoic acid, 3-(dimethylcarbamoylamino)benzoic Acid, Benzoic acid, 3-[[(dimethylamino)carbonyl]amino]-, 3-(3,3-Dimethylureido)benzoicacid
| Molecular Formula | C10H12N2O3 |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | 1.4783 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.0848 |
| Heavy Atoms | 15 |
| Complexity | 388.00882 |
Chemical Identifiers
| CAS Number | 896160-52-4 |
|---|---|
| SMILES | CN(C)C(=O)NC1=CC=CC(=C1)C(=O)O |
Product Overview
3-[(Dimethylcarbamoyl)amino]benzoic acid (CAS 896160-52-4), with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol. IUPAC: 3-(dimethylcarbamoylamino)benzoic acid.
Chemical Property Profile of 3-[(Dimethylcarbamoyl)amino]benzoic acid
Property Insights of 3-[(Dimethylcarbamoyl)amino]benzoic acid
The XLogP value of 1.4783 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Dimethylcarbamoyl)amino]benzoic acid. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Dimethylcarbamoyl)amino]benzoic acid. Following Lipinski's Rule of Five, 3-[(Dimethylcarbamoyl)amino]benzoic acid has 2 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 3-[(Dimethylcarbamoyl)amino]benzoic acid?
The CAS number of 3-[(Dimethylcarbamoyl)amino]benzoic acid is 896160-52-4.
What is the molecular formula of 3-[(Dimethylcarbamoyl)amino]benzoic acid?
The molecular formula of 3-[(Dimethylcarbamoyl)amino]benzoic acid is C10H12N2O3.
What is the molecular weight of 3-[(Dimethylcarbamoyl)amino]benzoic acid?
The molecular weight of 3-[(Dimethylcarbamoyl)amino]benzoic acid is 208.08 g/mol.
Where can I buy 3-[(Dimethylcarbamoyl)amino]benzoic acid?
You can request a quote for 3-[(Dimethylcarbamoyl)amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Dimethylcarbamoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Dimethylcarbamoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.