N-(3-cyanothiophen-2-yl)-4-methylbenzamide
TL;DR: N-(3-cyanothiophen-2-yl)-4-methylbenzamide (CAS 865545-69-3) is a chemical compound with molecular formula C13H10N2OS and molecular weight 242.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyanothiophen-2-yl)-4-methylbenzamide
Also Known As: N-(3-cyanothiophen-2-yl)-4-methylbenzamide, F1385-0003
| Molecular Formula | C13H10N2OS |
|---|---|
| Molecular Weight | 242.05 g/mol |
| LogP | 3.1805 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.05139 |
| Heavy Atoms | 17 |
| Complexity | 578.2121 |
Chemical Identifiers
| CAS Number | 865545-69-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=C(C=CS2)C#N |
Product Overview
N-(3-cyanothiophen-2-yl)-4-methylbenzamide (CAS 865545-69-3), with molecular formula C13H10N2OS and molecular weight 242.05 g/mol. IUPAC: N-(3-cyanothiophen-2-yl)-4-methylbenzamide.
Chemical Property Profile of N-(3-cyanothiophen-2-yl)-4-methylbenzamide
Property Insights of N-(3-cyanothiophen-2-yl)-4-methylbenzamide
The XLogP value of 3.1805 indicates that N-(3-cyanothiophen-2-yl)-4-methylbenzamide 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)-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyanothiophen-2-yl)-4-methylbenzamide 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 N-(3-cyanothiophen-2-yl)-4-methylbenzamide?
The CAS number of N-(3-cyanothiophen-2-yl)-4-methylbenzamide is 865545-69-3.
What is the molecular formula of N-(3-cyanothiophen-2-yl)-4-methylbenzamide?
The molecular formula of N-(3-cyanothiophen-2-yl)-4-methylbenzamide is C13H10N2OS.
What is the molecular weight of N-(3-cyanothiophen-2-yl)-4-methylbenzamide?
The molecular weight of N-(3-cyanothiophen-2-yl)-4-methylbenzamide is 242.05 g/mol.
Where can I buy N-(3-cyanothiophen-2-yl)-4-methylbenzamide?
You can request a quote for N-(3-cyanothiophen-2-yl)-4-methylbenzamide 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)-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyanothiophen-2-yl)-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.