1-溴-4-(4-硝基苯基)异喹啉-3-胺
TL;DR: 1-溴-4-(4-硝基苯基)异喹啉-3-胺 (CAS 31309-65-6) is a chemical compound with molecular formula C15H10BrN3O2 and molecular weight 343.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-溴-4-(4-硝基苯基)异喹啉-3-胺
1-bromo-4-(4-nitrophenyl)isoquinolin-3-amine
Also Known As: 1-bromo-4-(4-nitrophenyl)isoquinolin-3-amine, 3-ISOQUINOLINAMINE,1-BROMO-4-(4-NITROPHENYL)-
| Molecular Formula | C15H10BrN3O2 |
|---|---|
| Molecular Weight | 343.00 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 342.99564 |
| Heavy Atoms | 21 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 31309-65-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N=C2Br)N)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | IZPRAXCYBZIXIA-UHFFFAOYSA-N |
Product Overview
1-溴-4-(4-硝基苯基)异喹啉-3-胺 (CAS 31309-65-6), with molecular formula C15H10BrN3O2 and molecular weight 343.00 g/mol. IUPAC: 1-bromo-4-(4-nitrophenyl)isoquinolin-3-amine.
Chemical Property Profile of 1-溴-4-(4-硝基苯基)异喹啉-3-胺
Property Insights of 1-溴-4-(4-硝基苯基)异喹啉-3-胺
The XLogP value of 4.2 indicates that 1-溴-4-(4-硝基苯基)异喹啉-3-胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-溴-4-(4-硝基苯基)异喹啉-3-胺. Following Lipinski's Rule of Five, 1-溴-4-(4-硝基苯基)异喹啉-3-胺 has 1 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 1-溴-4-(4-硝基苯基)异喹啉-3-胺?
The CAS number of 1-溴-4-(4-硝基苯基)异喹啉-3-胺 is 31309-65-6.
What is the molecular formula of 1-溴-4-(4-硝基苯基)异喹啉-3-胺?
The molecular formula of 1-溴-4-(4-硝基苯基)异喹啉-3-胺 is C15H10BrN3O2.
What is the molecular weight of 1-溴-4-(4-硝基苯基)异喹啉-3-胺?
The molecular weight of 1-溴-4-(4-硝基苯基)异喹啉-3-胺 is 343.00 g/mol.
Where can I buy 1-溴-4-(4-硝基苯基)异喹啉-3-胺?
You can request a quote for 1-溴-4-(4-硝基苯基)异喹啉-3-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-溴-4-(4-硝基苯基)异喹啉-3-胺?
Yes, KEHONG BIO provides custom synthesis services for 1-溴-4-(4-硝基苯基)异喹啉-3-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.