![3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide structure](/static/products/3333/333398-34-8.webp)
3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide
TL;DR: 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide (CAS 333398-34-8) is a chemical compound with molecular formula C15H14BrN3O3 and molecular weight 363.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[2-(4-nitroanilino)ethyl]benzamide
Also Known As: 3-Bromo-N-(2-{4-nitroanilino}, 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide, 3-bromo-N-(2-{4-nitroanilino}ethyl)benzamide, 3-bromo-N-{2-[(4-nitrophenyl)amino]ethyl}benzamide, 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide #
| Molecular Formula | C15H14BrN3O3 |
|---|---|
| Molecular Weight | 363.02 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.02185 |
| Heavy Atoms | 22 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 333398-34-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | GVTZMKNKMGOFHE-UHFFFAOYSA-N |
Product Overview
3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide (CAS 333398-34-8), with molecular formula C15H14BrN3O3 and molecular weight 363.02 g/mol. IUPAC: 3-bromo-N-[2-(4-nitroanilino)ethyl]benzamide.
Chemical Property Profile of 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide
Property Insights of 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide
The XLogP value of 3.4 indicates that 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide. Following Lipinski's Rule of Five, 3-Bromo-N-[2-(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 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide?
The CAS number of 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide is 333398-34-8.
What is the molecular formula of 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide?
The molecular formula of 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide is C15H14BrN3O3.
What is the molecular weight of 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide?
The molecular weight of 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide is 363.02 g/mol.
Where can I buy 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide?
You can request a quote for 3-Bromo-N-[2-(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 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-N-[2-(4-nitroanilino)ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.