2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine
TL;DR: 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine (CAS 384349-42-2) is a chemical compound with molecular formula C17H16N4O2 and molecular weight 308.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)-N-propan-2-ylquinazolin-4-amine
Also Known As: 2-(4-nitrophenyl)-N-propan-2-ylquinazolin-4-amine, 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine, AB00119304-01, N-isopropyl-2-(4-nitrophenyl)-4-quinazolinamine, N-isopropyl-2-(4-nitrophenyl)quinazolin-4-amine
| Molecular Formula | C17H16N4O2 |
|---|---|
| Molecular Weight | 308.13 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.12732 |
| Heavy Atoms | 23 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 384349-42-2 |
|---|---|
| SMILES | CC(C)NC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | DNNPAYODTDGISE-UHFFFAOYSA-N |
Product Overview
2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine (CAS 384349-42-2), with molecular formula C17H16N4O2 and molecular weight 308.13 g/mol. IUPAC: 2-(4-nitrophenyl)-N-propan-2-ylquinazolin-4-amine.
Chemical Property Profile of 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine
Property Insights of 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine
The XLogP value of 4.5 indicates that 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine. Following Lipinski's Rule of Five, 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine has 1 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 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine?
The CAS number of 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine is 384349-42-2.
What is the molecular formula of 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine?
The molecular formula of 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine is C17H16N4O2.
What is the molecular weight of 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine?
The molecular weight of 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine is 308.13 g/mol.
Where can I buy 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine?
You can request a quote for 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-nitrophenyl)-N-(propan-2-yl)quinazolin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.