4-(4-Methoxy-phenylcarbamoyl)-butyric acid
TL;DR: 4-(4-Methoxy-phenylcarbamoyl)-butyric acid (CAS 199168-31-5) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methoxyanilino)-5-oxopentanoic acid
Also Known As: CBKinase1_000597, CBKinase1_012997, 4-(4-Methoxy-phenylcarbamoyl)-butyric acid, 5-(4-methoxyphenylamino)-5-oxopentanoic acid, 5-(4-methoxyanilino)-5-oxopentanoic acid
| Molecular Formula | C12H15NO4 |
|---|---|
| Molecular Weight | 237.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 199168-31-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CCCC(=O)O |
| InChIKey | ROTYPWQVVUPAQG-UHFFFAOYSA-N |
Product Overview
4-(4-Methoxy-phenylcarbamoyl)-butyric acid (CAS 199168-31-5), with molecular formula C12H15NO4 and molecular weight 237.10 g/mol. IUPAC: 5-(4-methoxyanilino)-5-oxopentanoic acid.
Chemical Property Profile of 4-(4-Methoxy-phenylcarbamoyl)-butyric acid
Property Insights of 4-(4-Methoxy-phenylcarbamoyl)-butyric acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methoxy-phenylcarbamoyl)-butyric acid. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methoxy-phenylcarbamoyl)-butyric acid. Following Lipinski's Rule of Five, 4-(4-Methoxy-phenylcarbamoyl)-butyric acid has 2 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 4-(4-Methoxy-phenylcarbamoyl)-butyric acid?
The CAS number of 4-(4-Methoxy-phenylcarbamoyl)-butyric acid is 199168-31-5.
What is the molecular formula of 4-(4-Methoxy-phenylcarbamoyl)-butyric acid?
The molecular formula of 4-(4-Methoxy-phenylcarbamoyl)-butyric acid is C12H15NO4.
What is the molecular weight of 4-(4-Methoxy-phenylcarbamoyl)-butyric acid?
The molecular weight of 4-(4-Methoxy-phenylcarbamoyl)-butyric acid is 237.10 g/mol.
Where can I buy 4-(4-Methoxy-phenylcarbamoyl)-butyric acid?
You can request a quote for 4-(4-Methoxy-phenylcarbamoyl)-butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methoxy-phenylcarbamoyl)-butyric acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxy-phenylcarbamoyl)-butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.