![4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide structure](/static/products/4320/432003-63-9.webp)
4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide
TL;DR: 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide (CAS 432003-63-9) is a chemical compound with molecular formula C21H18BrNOS and molecular weight 411.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide
Also Known As: 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide, 4-bromo-N-{2-methyl-4-[(phenylsulfanyl)methyl]phenyl}benzamide, AH-487/40936773, 4-bromo-N-{2-methyl-4-[(phenylthio)methyl]phenyl}benzamide
| Molecular Formula | C21H18BrNOS |
|---|---|
| Molecular Weight | 411.03 g/mol |
| LogP | 6.30212 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.02924 |
| Heavy Atoms | 25 |
| Complexity | 862.82434 |
Chemical Identifiers
| CAS Number | 432003-63-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)Br |
Product Overview
4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide (CAS 432003-63-9), with molecular formula C21H18BrNOS and molecular weight 411.03 g/mol. IUPAC: 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide.
Chemical Property Profile of 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide
Property Insights of 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide
The XLogP value of 6.30212 indicates that 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide?
The CAS number of 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide is 432003-63-9.
What is the molecular formula of 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide?
The molecular formula of 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide is C21H18BrNOS.
What is the molecular weight of 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide?
The molecular weight of 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide is 411.03 g/mol.
Where can I buy 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide?
You can request a quote for 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.