N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide
TL;DR: N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide (CAS 896343-64-9) is a chemical compound with molecular formula C13H10N2OS2 and molecular weight 274.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide
Also Known As: N-(3-cyanothiophen-2-yl)-3-(methylthio)benzamide, N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide, N-(3-cyanothiophen-2-yl)-3-(methylsulfanyl)benzamide, F2554-0227
| Molecular Formula | C13H10N2OS2 |
|---|---|
| Molecular Weight | 274.02 g/mol |
| LogP | 3.59398 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.02347 |
| Heavy Atoms | 18 |
| Complexity | 613.449 |
Chemical Identifiers
| CAS Number | 896343-64-9 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)C(=O)NC2=C(C=CS2)C#N |
Product Overview
N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide (CAS 896343-64-9), with molecular formula C13H10N2OS2 and molecular weight 274.02 g/mol. IUPAC: N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide.
Chemical Property Profile of N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide
Property Insights of N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide
The XLogP value of 3.59398 indicates that N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide has 1 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 N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide?
The CAS number of N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide is 896343-64-9.
What is the molecular formula of N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide?
The molecular formula of N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide is C13H10N2OS2.
What is the molecular weight of N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide?
The molecular weight of N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide is 274.02 g/mol.
Where can I buy N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide?
You can request a quote for N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyanothiophen-2-yl)-3-methylsulfanylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.