N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide
TL;DR: N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide (CAS 648409-31-8) is a chemical compound with molecular formula C15H12BrClN2O3S and molecular weight 413.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[2-(4-chloro-2-nitrophenyl)sulfanylphenyl]propanamide
Also Known As: N1-(2-[(4-CHLORO-2-NITROPHENYL)THIO]PHENYL)-2-BROMOPROPANAMIDE, 2-bromo-N-{2-[(4-chloro-2-nitrophenyl)sulfanyl]phenyl}propanamide, Propanamide, 2-bromo-N-[2-[(4-chloro-2-nitrophenyl)thio]phenyl]-, 2-Bromo-N-[2-[(4-chloro-2-nitrophenyl)thio]phenyl]propanamide, 2-bromo-N-[2-(4-chloro-2-nitrophenyl)sulfanylphenyl]propanamide
| Molecular Formula | C15H12BrClN2O3S |
|---|---|
| Molecular Weight | 413.94 g/mol |
| LogP | 5.1213 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.94406 |
| Heavy Atoms | 23 |
| Complexity | 755.2519 |
Chemical Identifiers
| CAS Number | 648409-31-8 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=CC=C1SC2=C(C=C(C=C2)Cl)[N+](=O)[O-])Br |
Product Overview
N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide (CAS 648409-31-8), with molecular formula C15H12BrClN2O3S and molecular weight 413.94 g/mol. IUPAC: 2-bromo-N-[2-(4-chloro-2-nitrophenyl)sulfanylphenyl]propanamide.
Chemical Property Profile of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide
Property Insights of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide
The XLogP value of 5.1213 indicates that N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide. Following Lipinski's Rule of Five, N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide?
The CAS number of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide is 648409-31-8.
What is the molecular formula of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide?
The molecular formula of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide is C15H12BrClN2O3S.
What is the molecular weight of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide?
The molecular weight of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide is 413.94 g/mol.
Where can I buy N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide?
You can request a quote for N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide?
Yes, KEHONG BIO provides custom synthesis services for N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.