N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide
TL;DR: N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide (CAS 5876-36-8) is a chemical compound with molecular formula C31H33N3O2 and molecular weight 479.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-phenylprop-2-enamide
Also Known As: N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide, N-[1-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-phenylprop-2-enamide
| Molecular Formula | C31H33N3O2 |
|---|---|
| Molecular Weight | 479.26 g/mol |
| LogP | 6.26154 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 479.25726 |
| Heavy Atoms | 36 |
| Complexity | 1468.6837 |
Chemical Identifiers
| CAS Number | 5876-36-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CC(C)C)C(=O)C=CC4=CC=CC=C4 |
Product Overview
N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide (CAS 5876-36-8), with molecular formula C31H33N3O2 and molecular weight 479.26 g/mol. IUPAC: N-[1-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-phenylprop-2-enamide.
Chemical Property Profile of N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide
Property Insights of N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide
The XLogP value of 6.26154 indicates that N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide?
The CAS number of N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide is 5876-36-8.
What is the molecular formula of N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide?
The molecular formula of N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide is C31H33N3O2.
What is the molecular weight of N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide?
The molecular weight of N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide is 479.26 g/mol.
Where can I buy N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide?
You can request a quote for N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-{1-[3-(2,5-Dimethylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethyl}-N-(2-methylpropyl)-3-phenylprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.