![5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile structure](/static/products/3031/303148-03-0.webp)
5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile
TL;DR: 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile (CAS 303148-03-0) is a chemical compound with molecular formula C14H12N2S and molecular weight 240.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-(4-methylphenyl)sulfanylbenzonitrile
Also Known As: 5-Amino-2-(p-tolylthio)benzonitrile, 5-amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile, 5-amino-2-(4-methylphenyl)sulfanylbenzonitrile, 5-Amino-2-[(4-methylphenyl)sulfanyl]-benzenecarbonitrile, 5-amino-2-(p-tolylsulfanyl)benzonitrile
| Molecular Formula | C14H12N2S |
|---|---|
| Molecular Weight | 240.07 g/mol |
| LogP | 3.6001 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.07211 |
| Heavy Atoms | 17 |
| Complexity | 567.76636 |
Chemical Identifiers
| CAS Number | 303148-03-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC2=C(C=C(C=C2)N)C#N |
Product Overview
5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile (CAS 303148-03-0), with molecular formula C14H12N2S and molecular weight 240.07 g/mol. IUPAC: 5-amino-2-(4-methylphenyl)sulfanylbenzonitrile.
Chemical Property Profile of 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile
Property Insights of 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile
The XLogP value of 3.6001 indicates that 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.81 Ų, 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile 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 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile?
The CAS number of 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile is 303148-03-0.
What is the molecular formula of 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile?
The molecular formula of 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile is C14H12N2S.
What is the molecular weight of 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile?
The molecular weight of 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile is 240.07 g/mol.
Where can I buy 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile?
You can request a quote for 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-2-[(4-methylphenyl)sulfanyl]benzenecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.