N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide structure

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

CAS: 648409-31-8
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.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of N1-(2-[(4-Chloro-2-nitrophenyl)thio]phenyl)-2-bromopropanamide

XLogP
5.1213
TPSA (Topological Polar Surface Area)
72.24
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
23
Complexity
755.2519
Exact Mass
413.94406
Monoisotopic Mass
413.94406
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

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.

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