![4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid structure](/static/products/4780/478046-25-2.webp)
4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid
TL;DR: 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid (CAS 478046-25-2) is a chemical compound with molecular formula C13H14N2O2S and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-phenylimidazol-2-yl)sulfanylbutanoic acid
Also Known As: Bionet2_000382, 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid, 4-(1-phenylimidazol-2-yl)sulfanylbutanoic acid, US20240317691, Compound 112, 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoicacid
| Molecular Formula | C13H14N2O2S |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 2.8292 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 262.0776 |
| Heavy Atoms | 18 |
| Complexity | 510.7196 |
Chemical Identifiers
| CAS Number | 478046-25-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=CN=C2SCCCC(=O)O |
Product Overview
4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid (CAS 478046-25-2), with molecular formula C13H14N2O2S and molecular weight 262.08 g/mol. IUPAC: 4-(1-phenylimidazol-2-yl)sulfanylbutanoic acid.
Chemical Property Profile of 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid
Property Insights of 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid
The XLogP value of 2.8292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid. With a topological polar surface area (TPSA) of 55.12 Ų, 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid has 1 hydrogen bond donor(s) and 3 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-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid?
The CAS number of 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid is 478046-25-2.
What is the molecular formula of 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid?
The molecular formula of 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid is C13H14N2O2S.
What is the molecular weight of 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid?
The molecular weight of 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid is 262.08 g/mol.
Where can I buy 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid?
You can request a quote for 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]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-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.