![4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid structure](/static/products/890/890355-71-2.png)
4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid
TL;DR: 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid (CAS 890355-71-2) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-(propylcarbamoylamino)benzoic acid
Also Known As: 4-methyl-3-(3-propylureido)benzoic acid, 4-methyl-3-(propylcarbamoylamino)benzoic Acid, 4-methyl-3-[(propylcarbamoyl)amino]benzoic acid, 4-methyl-3-[(propylamino)carbonylamino]benzoic acid, 4-METHYL-3-{[(PROPYLAMINO)CARBONYL]AMINO}BENZOIC ACID
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 2.22472 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 429.75897 |
Chemical Identifiers
| CAS Number | 890355-71-2 |
|---|---|
| SMILES | CCCNC(=O)NC1=C(C=CC(=C1)C(=O)O)C |
Product Overview
4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid (CAS 890355-71-2), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: 4-methyl-3-(propylcarbamoylamino)benzoic acid.
Chemical Property Profile of 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid
Property Insights of 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid
The XLogP value of 2.22472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid. Following Lipinski's Rule of Five, 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid 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 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid?
The CAS number of 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid is 890355-71-2.
What is the molecular formula of 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid?
The molecular formula of 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid is C12H16N2O3.
What is the molecular weight of 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid?
The molecular weight of 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid is 236.12 g/mol.
Where can I buy 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid?
You can request a quote for 4-Methyl-3-[(propylcarbamoyl)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 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-3-[(propylcarbamoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.