ChemDiv3_014994
TL;DR: ChemDiv3_014994 (CAS 726200-40-4) is a chemical compound with molecular formula C23H30N4O4 and molecular weight 426.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-ethylpiperazin-1-yl)-7-(3,4,5-trimethoxyphenyl)-7,8-dihydro-6H-quinazolin-5-one
Also Known As: ChemDiv3_014994, 2-(4-ethylpiperazin-1-yl)-7-(3,4,5-trimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one, 2-(4-ethylpiperazin-1-yl)-7-(3,4,5-trimethoxyphenyl)-7,8-dihydro-6H-quinazolin-5-one, 2-(4-ethylpiperazinyl)-7-(3,4,5-trimethoxyphenyl)-6,7,8-trihydroquinazolin-5-o ne, 2-(4-ETHYLPIPERAZIN-1-YL)-7-(3,4,5-TRIMETHOXYPHENYL)-5,6,7,8-TETRAHYDROQUINAZOLIN-5-ONE
| Molecular Formula | C23H30N4O4 |
|---|---|
| Molecular Weight | 426.23 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 77.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.2267 |
| Heavy Atoms | 31 |
| Complexity | 586.0 |
Chemical Identifiers
| CAS Number | 726200-40-4 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=NC=C3C(=N2)CC(CC3=O)C4=CC(=C(C(=C4)OC)OC)OC |
| InChIKey | LFCXGNKMUFQVTH-UHFFFAOYSA-N |
Product Overview
ChemDiv3_014994 (CAS 726200-40-4), with molecular formula C23H30N4O4 and molecular weight 426.23 g/mol. IUPAC: 2-(4-ethylpiperazin-1-yl)-7-(3,4,5-trimethoxyphenyl)-7,8-dihydro-6H-quinazolin-5-one.
Chemical Property Profile of ChemDiv3_014994
Property Insights of ChemDiv3_014994
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_014994. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_014994. Following Lipinski's Rule of Five, ChemDiv3_014994 has 0 hydrogen bond donor(s) and 8 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 ChemDiv3_014994?
The CAS number of ChemDiv3_014994 is 726200-40-4.
What is the molecular formula of ChemDiv3_014994?
The molecular formula of ChemDiv3_014994 is C23H30N4O4.
What is the molecular weight of ChemDiv3_014994?
The molecular weight of ChemDiv3_014994 is 426.23 g/mol.
Where can I buy ChemDiv3_014994?
You can request a quote for ChemDiv3_014994 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_014994?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_014994 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.