![N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide structure](/static/products/839/839693-31-1.png)
N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide
TL;DR: N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide (CAS 839693-31-1) is a chemical compound with molecular formula C21H20N2OS and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(4-methylsulfanylphenyl)methylamino]phenyl]benzamide
Also Known As: N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide, AN-465/43369680, N-[3-[(4-methylsulfanylphenyl)methylamino]phenyl]benzamide, N-[3-(4-Methylsulfanyl-benzylamino)-phenyl]-benzamide, N-[3-({[4-(METHYLSULFANYL)PHENYL]METHYL}AMINO)PHENYL]BENZAMIDE
| Molecular Formula | C21H20N2OS |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | 5.2729 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 348.12964 |
| Heavy Atoms | 25 |
| Complexity | 832.0296 |
Chemical Identifiers
| CAS Number | 839693-31-1 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)CNC2=CC(=CC=C2)NC(=O)C3=CC=CC=C3 |
Product Overview
N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide (CAS 839693-31-1), with molecular formula C21H20N2OS and molecular weight 348.13 g/mol. IUPAC: N-[3-[(4-methylsulfanylphenyl)methylamino]phenyl]benzamide.
Chemical Property Profile of N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide
Property Insights of N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide
The XLogP value of 5.2729 indicates that N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide has 2 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-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide?
The CAS number of N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide is 839693-31-1.
What is the molecular formula of N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide?
The molecular formula of N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide is C21H20N2OS.
What is the molecular weight of N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide?
The molecular weight of N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide is 348.13 g/mol.
Where can I buy N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide?
You can request a quote for N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-{[4-(methylsulfanyl)benzyl]amino}phenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.