(2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide
TL;DR: (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide (CAS 845899-52-7) is a chemical compound with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide
Also Known As: (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide, (E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(o-tolyl)acrylamide, (E)-N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide, (2E)-N-(7,7-dimethyl-5-oxo(6,7,8-trihydroquinazolin-2-yl))-3-(2-methylphenyl)p rop-2-enamide, (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)acrylamide
| Molecular Formula | C20H21N3O2 |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 3.59202 |
| Topological Polar Surface Area | 71.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.1634 |
| Heavy Atoms | 25 |
| Complexity | 868.99506 |
Chemical Identifiers
| CAS Number | 845899-52-7 |
|---|---|
| SMILES | CC1=CC=CC=C1/C=C/C(=O)NC2=NC=C3C(=N2)CC(CC3=O)(C)C |
Product Overview
(2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide (CAS 845899-52-7), with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol. IUPAC: (E)-N-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide.
Chemical Property Profile of (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide
Property Insights of (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide
The XLogP value of 3.59202 indicates that (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.95 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide. Following Lipinski's Rule of Five, (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide 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 (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide?
The CAS number of (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide is 845899-52-7.
What is the molecular formula of (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide?
The molecular formula of (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide is C20H21N3O2.
What is the molecular weight of (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide?
The molecular weight of (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide is 335.16 g/mol.
Where can I buy (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide?
You can request a quote for (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.