![4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid structure](/static/products/373/3738-97-4.png)
4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid
TL;DR: 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid (CAS 3738-97-4) is a chemical compound with molecular formula C11H13ClN2O2S and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chlorophenyl)carbamothioylamino]butanoic acid
Also Known As: 4-[3-(p-Chlorophenyl)thioureido]butyric acid, 4-(3-(4-chlorophenyl)thioureido)butanoic acid, 4-[(4-chlorophenyl)carbamothioylamino]butanoic acid, 4-[(4-chlorophenyl)thiocarbamoylamino]butanoic Acid, 4-{[(4-chlorophenyl)carbamothioyl]amino}butanoic acid
| Molecular Formula | C11H13ClN2O2S |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 2.4912 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 272.03864 |
| Heavy Atoms | 17 |
| Complexity | 394.96283 |
Chemical Identifiers
| CAS Number | 3738-97-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=S)NCCCC(=O)O)Cl |
Product Overview
4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid (CAS 3738-97-4), with molecular formula C11H13ClN2O2S and molecular weight 272.04 g/mol. IUPAC: 4-[(4-chlorophenyl)carbamothioylamino]butanoic acid.
Chemical Property Profile of 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid
Property Insights of 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid
The XLogP value of 2.4912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid. Following Lipinski's Rule of Five, 4-[(4-Chlorophenyl)carbamothioylamino]butanoic 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-[(4-Chlorophenyl)carbamothioylamino]butanoic acid?
The CAS number of 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid is 3738-97-4.
What is the molecular formula of 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid?
The molecular formula of 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid is C11H13ClN2O2S.
What is the molecular weight of 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid?
The molecular weight of 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid is 272.04 g/mol.
Where can I buy 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid?
You can request a quote for 4-[(4-Chlorophenyl)carbamothioylamino]butanoic 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-Chlorophenyl)carbamothioylamino]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Chlorophenyl)carbamothioylamino]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.