4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide
TL;DR: 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide (CAS 347311-76-6) is a chemical compound with molecular formula C18H19BrN4O3 and molecular weight 418.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[2-[3-(cyclopropylamino)-4-nitroanilino]ethyl]benzamide
Also Known As: 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide, 4-bromo-N-[2-[3-(cyclopropylamino)-4-nitroanilino]ethyl]benzamide, 4-bromo-N-(2-((3-(cyclopropylamino)-4-nitrophenyl)amino)ethyl)benzamide, 4-bromo-N-(2-{[3-(cyclopropylamino)-4-nitrophenyl]amino}ethyl)benzamide
| Molecular Formula | C18H19BrN4O3 |
|---|---|
| Molecular Weight | 418.06 g/mol |
| LogP | 3.7735 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 418.06406 |
| Heavy Atoms | 26 |
| Complexity | 806.58356 |
Chemical Identifiers
| CAS Number | 347311-76-6 |
|---|---|
| SMILES | C1CC1NC2=C(C=CC(=C2)NCCNC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-] |
Product Overview
4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide (CAS 347311-76-6), with molecular formula C18H19BrN4O3 and molecular weight 418.06 g/mol. IUPAC: 4-bromo-N-[2-[3-(cyclopropylamino)-4-nitroanilino]ethyl]benzamide.
Chemical Property Profile of 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide
Property Insights of 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide
The XLogP value of 3.7735 indicates that 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide. Following Lipinski's Rule of Five, 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide has 3 hydrogen bond donor(s) and 5 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 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide?
The CAS number of 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide is 347311-76-6.
What is the molecular formula of 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide?
The molecular formula of 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide is C18H19BrN4O3.
What is the molecular weight of 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide?
The molecular weight of 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide is 418.06 g/mol.
Where can I buy 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide?
You can request a quote for 4-bromo-N-(2-{3-(cyclopropylamino)-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 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(2-{3-(cyclopropylamino)-4-nitroanilino}ethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.