3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione
TL;DR: 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione (CAS 900259-87-2) is a chemical compound with molecular formula C17H15ClN2S and molecular weight 314.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione
Also Known As: 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione, 3-(3-chlorophenyl)-6,8-dimethyl-4-methylene-3,4-dihydroquinazoline-2(1H)-thione, 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-3,4-dihydroquinazoline-2(1H)-thione
| Molecular Formula | C17H15ClN2S |
|---|---|
| Molecular Weight | 314.06 g/mol |
| LogP | 5.14454 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.06445 |
| Heavy Atoms | 21 |
| Complexity | 767.38055 |
Chemical Identifiers
| CAS Number | 900259-87-2 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)C(=C)N(C(=S)N2)C3=CC(=CC=C3)Cl)C |
Product Overview
3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione (CAS 900259-87-2), with molecular formula C17H15ClN2S and molecular weight 314.06 g/mol. IUPAC: 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione.
Chemical Property Profile of 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione
Property Insights of 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione
The XLogP value of 5.14454 indicates that 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.27 Ų, 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione?
The CAS number of 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione is 900259-87-2.
What is the molecular formula of 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione?
The molecular formula of 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione is C17H15ClN2S.
What is the molecular weight of 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione?
The molecular weight of 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione is 314.06 g/mol.
Where can I buy 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione?
You can request a quote for 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-chlorophenyl)-6,8-dimethyl-4-methylidene-1H-quinazoline-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.