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N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide
TL;DR: N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide (CAS 367478-23-7) is a chemical compound with molecular formula C22H18N2OS and molecular weight 358.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide
Also Known As: N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide, N-[4-(cyanomethyl)phenyl]-4-[(phenylsulfanyl)methyl]benzamide
| Molecular Formula | C22H18N2OS |
|---|---|
| Molecular Weight | 358.11 g/mol |
| LogP | 5.29728 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.11398 |
| Heavy Atoms | 26 |
| Complexity | 897.6272 |
Chemical Identifiers
| CAS Number | 367478-23-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N |
Product Overview
N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide (CAS 367478-23-7), with molecular formula C22H18N2OS and molecular weight 358.11 g/mol. IUPAC: N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide.
Chemical Property Profile of N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide
Property Insights of N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide
The XLogP value of 5.29728 indicates that N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide 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-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide?
The CAS number of N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide is 367478-23-7.
What is the molecular formula of N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide?
The molecular formula of N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide is C22H18N2OS.
What is the molecular weight of N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide?
The molecular weight of N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide is 358.11 g/mol.
Where can I buy N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide?
You can request a quote for N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.