![3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid structure](/static/products/4240/4240-95-3.webp)
3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid
TL;DR: 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid (CAS 4240-95-3) is a chemical compound with molecular formula C11H13NO3S2 and molecular weight 271.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-methoxyphenyl)carbamothioylsulfanyl]propanoic acid
Also Known As: 3-[(4-methoxyphenyl)carbamothioylsulfanyl]propanoic acid, 3-{[(4-methoxyphenyl)carbamothioyl]sulfanyl}propanoic acid
| Molecular Formula | C11H13NO3S2 |
|---|---|
| Molecular Weight | 271.03 g/mol |
| LogP | 2.5999 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.0337 |
| Heavy Atoms | 17 |
| Complexity | 392.20795 |
Chemical Identifiers
| CAS Number | 4240-95-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=S)SCCC(=O)O |
Product Overview
3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid (CAS 4240-95-3), with molecular formula C11H13NO3S2 and molecular weight 271.03 g/mol. IUPAC: 3-[(4-methoxyphenyl)carbamothioylsulfanyl]propanoic acid.
Chemical Property Profile of 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid
Property Insights of 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid
The XLogP value of 2.5999 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid. With a topological polar surface area (TPSA) of 58.56 Ų, 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic 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 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid?
The CAS number of 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid is 4240-95-3.
What is the molecular formula of 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid?
The molecular formula of 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid is C11H13NO3S2.
What is the molecular weight of 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid?
The molecular weight of 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid is 271.03 g/mol.
Where can I buy 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid?
You can request a quote for 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]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-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Methoxyphenyl)carbamothioylsulfanyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.