ChemDiv3_000403
TL;DR: ChemDiv3_000403 (CAS 65331-30-8) is a chemical compound with molecular formula C23H24N2O2S and molecular weight 392.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyphenyl)-8-[(4-methoxyphenyl)methylidene]-1,3,4,5,6,7-hexahydroquinazoline-2-thione
Also Known As: ChemDiv3_000403, 4-(4-methoxyphenyl)-8-[(4-methoxyphenyl)methylidene]-1,3,4,5,6,7-hexahydroquinazoline-2-thione, (8E)-4-(4-methoxyphenyl)-8-[(4-methoxyphenyl)methylidene]-1,, (8Z)-4-(4-methoxyphenyl)-8-[(4-methoxyphenyl)methylidene]-1,2,3,4,5,6,7,8-octahydroquinazoline-2-thione, 8-(4-Methoxybenzylidene)-4-(4-methoxyphenyl)-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
| Molecular Formula | C23H24N2O2S |
|---|---|
| Molecular Weight | 392.16 g/mol |
| LogP | 4.7442 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.15585 |
| Heavy Atoms | 28 |
| Complexity | 930.0796 |
Chemical Identifiers
| CAS Number | 65331-30-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=C2CCCC3=C2NC(=S)NC3C4=CC=C(C=C4)OC |
Product Overview
ChemDiv3_000403 (CAS 65331-30-8), with molecular formula C23H24N2O2S and molecular weight 392.16 g/mol. IUPAC: 4-(4-methoxyphenyl)-8-[(4-methoxyphenyl)methylidene]-1,3,4,5,6,7-hexahydroquinazoline-2-thione.
Chemical Property Profile of ChemDiv3_000403
Property Insights of ChemDiv3_000403
The XLogP value of 4.7442 indicates that ChemDiv3_000403 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.52 Ų, ChemDiv3_000403 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_000403 has 2 hydrogen bond donor(s) and 3 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_000403?
The CAS number of ChemDiv3_000403 is 65331-30-8.
What is the molecular formula of ChemDiv3_000403?
The molecular formula of ChemDiv3_000403 is C23H24N2O2S.
What is the molecular weight of ChemDiv3_000403?
The molecular weight of ChemDiv3_000403 is 392.16 g/mol.
Where can I buy ChemDiv3_000403?
You can request a quote for ChemDiv3_000403 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_000403?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_000403 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.