N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide
TL;DR: N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide (CAS 327981-35-1) is a chemical compound with molecular formula C17H16N4O4 and molecular weight 340.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-4-nitrobenzamide
Also Known As: N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide, N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-4-nitrobenzamide, N-(7,7-dimethyl-5-oxo(6,7,8-trihydroquinazolin-2-yl))(4-nitrophenyl)carboxamid e
| Molecular Formula | C17H16N4O4 |
|---|---|
| Molecular Weight | 340.12 g/mol |
| LogP | 2.7922 |
| Topological Polar Surface Area | 115.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.11716 |
| Heavy Atoms | 25 |
| Complexity | 874.7166 |
Chemical Identifiers
| CAS Number | 327981-35-1 |
|---|---|
| SMILES | CC1(CC2=NC(=NC=C2C(=O)C1)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C |
Product Overview
N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide (CAS 327981-35-1), with molecular formula C17H16N4O4 and molecular weight 340.12 g/mol. IUPAC: N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-4-nitrobenzamide.
Chemical Property Profile of N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide
Property Insights of N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide
The XLogP value of 2.7922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide. The TPSA of 115.09 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide has 1 hydrogen bond donor(s) and 6 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 N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide?
The CAS number of N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide is 327981-35-1.
What is the molecular formula of N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide?
The molecular formula of N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide is C17H16N4O4.
What is the molecular weight of N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide?
The molecular weight of N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide is 340.12 g/mol.
Where can I buy N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide?
You can request a quote for N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.