2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide
TL;DR: 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide (CAS 330826-75-0) is a chemical compound with molecular formula C15H13BrClN3O3 and molecular weight 396.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide
Also Known As: BAS 02082688, BIM-0007311.P001, AB00102272-01, 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide, 2-Bromo-N-[2-(2-chloro-4-nitro-phenylamino)-ethyl]-benzamide
| Molecular Formula | C15H13BrClN3O3 |
|---|---|
| Molecular Weight | 396.98 g/mol |
| LogP | 3.8526 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.98288 |
| Heavy Atoms | 23 |
| Complexity | 739.6571 |
Chemical Identifiers
| CAS Number | 330826-75-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Br |
Product Overview
2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide (CAS 330826-75-0), with molecular formula C15H13BrClN3O3 and molecular weight 396.98 g/mol. IUPAC: 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide.
Chemical Property Profile of 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide
Property Insights of 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide
The XLogP value of 3.8526 indicates that 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide. Following Lipinski's Rule of Five, 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide?
The CAS number of 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide is 330826-75-0.
What is the molecular formula of 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide?
The molecular formula of 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide is C15H13BrClN3O3.
What is the molecular weight of 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide?
The molecular weight of 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide is 396.98 g/mol.
Where can I buy 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide?
You can request a quote for 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.