8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione
TL;DR: 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione (CAS 1606158-60-4) is a chemical compound with molecular formula C25H28N2O4S and molecular weight 452.17697 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8E)-4-(3,4-dimethoxyphenyl)-8-[(3,4-dimethoxyphenyl)methylidene]-1,3,4,5,6,7-hexahydroquinazoline-2-thione
Also Known As: 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione, AQ-090/41729186, (8E)-4-(3,4-dimethoxyphenyl)-8-[(3,4-dimethoxyphenyl)methylidene]-1,3,4,5,6,7-hexahydroquinazoline-2-thione, (8E)-8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione, (E)-8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
Technical Specifications
| Molecular Formula | C25H28N2O4S |
| Molecular Weight | 452.17697 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.17697 Da |
| Heavy Atoms | 32 |
| Complexity | 739.0 |
| SMILES | COC1=C(C=C(C=C1)/C=C/2\CCCC3=C2NC(=S)NC3C4=CC(=C(C=C4)OC)OC)OC |
| InChIKey | UZMHXICLVJPVLZ-FOWTUZBSSA-N |
Chemical Property Profile of 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione
Property Insights of 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione
The XLogP value of 3.8 indicates that 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione. Following Lipinski's Rule of Five, 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione?
The CAS number of 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione is 1606158-60-4.
What is the molecular formula of 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione?
The molecular formula of 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione is C25H28N2O4S.
What is the molecular weight of 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione?
The molecular weight of 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione is 452.17697 g/mol.
Where can I buy 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione?
You can request a quote for 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione?
Yes, CoreyChem provides custom synthesis services for 8-(3,4-dimethoxybenzylidene)-4-(3,4-dimethoxyphenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.