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N-[氰基(甲硫基)甲基]苯甲酰胺
TL;DR: N-[氰基(甲硫基)甲基]苯甲酰胺 (CAS 13243-42-0) is a chemical compound with molecular formula C10H10N2OS and molecular weight 206.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[氰基(甲硫基)甲基]苯甲酰胺
N-[cyano(methylsulfanyl)methyl]benzamide
Also Known As: alpha-Methylmercaptohippuronitrile, N-(Cyano(methylthio)methyl)benzamide, N-[cyano(methylsulfanyl)methyl]benzamide, BENZAMIDE, N-(CYANO(METHYLTHIO)METHYL)-, Benzamide, N-[cyano(methylthio)methyl]-
| Molecular Formula | C10H10N2OS |
|---|---|
| Molecular Weight | 206.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.05139 |
| Heavy Atoms | 14 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 13243-42-0 |
|---|---|
| SMILES | CSC(C#N)NC(=O)C1=CC=CC=C1 |
| InChIKey | PIWOOBRDXRKMQO-UHFFFAOYSA-N |
Product Overview
N-[氰基(甲硫基)甲基]苯甲酰胺 (CAS 13243-42-0), with molecular formula C10H10N2OS and molecular weight 206.05 g/mol. IUPAC: N-[cyano(methylsulfanyl)methyl]benzamide.
Chemical Property Profile of N-[氰基(甲硫基)甲基]苯甲酰胺
Property Insights of N-[氰基(甲硫基)甲基]苯甲酰胺
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[氰基(甲硫基)甲基]苯甲酰胺. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[氰基(甲硫基)甲基]苯甲酰胺. Following Lipinski's Rule of Five, N-[氰基(甲硫基)甲基]苯甲酰胺 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-[氰基(甲硫基)甲基]苯甲酰胺?
The CAS number of N-[氰基(甲硫基)甲基]苯甲酰胺 is 13243-42-0.
What is the molecular formula of N-[氰基(甲硫基)甲基]苯甲酰胺?
The molecular formula of N-[氰基(甲硫基)甲基]苯甲酰胺 is C10H10N2OS.
What is the molecular weight of N-[氰基(甲硫基)甲基]苯甲酰胺?
The molecular weight of N-[氰基(甲硫基)甲基]苯甲酰胺 is 206.05 g/mol.
Where can I buy N-[氰基(甲硫基)甲基]苯甲酰胺?
You can request a quote for N-[氰基(甲硫基)甲基]苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[氰基(甲硫基)甲基]苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-[氰基(甲硫基)甲基]苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.