3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid
TL;DR: 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid (CAS 74182-38-0) is a chemical compound with molecular formula C11H12N2O4 and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-carbamoylanilino)-4-oxobutanoic acid
Also Known As: N-(3-Carbamoyl-phenyl)-succinamic acid, 3-[(3-carbamoylphenyl)carbamoyl]propanoic acid, BAS 00632353, 4-((3-Carbamoylphenyl)amino)-4-oxobutanoic acid, 4-(3-carbamoylanilino)-4-oxobutanoic acid
| Molecular Formula | C11H12N2O4 |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.07971 |
| Heavy Atoms | 17 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 74182-38-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)CCC(=O)O)C(=O)N |
| InChIKey | IQDYBIOBYSQBQY-UHFFFAOYSA-N |
Product Overview
3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid (CAS 74182-38-0), with molecular formula C11H12N2O4 and molecular weight 236.08 g/mol. IUPAC: 4-(3-carbamoylanilino)-4-oxobutanoic acid.
Chemical Property Profile of 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid
Property Insights of 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid. Following Lipinski's Rule of Five, 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid has 3 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 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid?
The CAS number of 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid is 74182-38-0.
What is the molecular formula of 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid?
The molecular formula of 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid is C11H12N2O4.
What is the molecular weight of 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid?
The molecular weight of 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid is 236.08 g/mol.
Where can I buy 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid?
You can request a quote for 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-Carbamoylphenyl)carbamoyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.