4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-
TL;DR: 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- (CAS 17730-53-9) is a chemical compound with molecular formula C10H10N2OS and molecular weight 206.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-2-sulfanylidenequinazolin-4-one
Also Known As: 1,3-dimethyl-2-sulfanylidenequinazolin-4-one, 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-, 1,3-Dimethyl-2-thioxo-2,3-dihydroquinazolin-4(1H)-one, Dimethyl-1,3 oxo-4 thioxo-2 (1H,3H)quinazoline, 5-24-07-00526 (Beilstein Handbook Reference)
| Molecular Formula | C10H10N2OS |
|---|---|
| Molecular Weight | 206.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.05139 |
| Heavy Atoms | 14 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 17730-53-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=O)N(C1=S)C |
| InChIKey | GIZBHMKUYIKTCC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- (CAS 17730-53-9), with molecular formula C10H10N2OS and molecular weight 206.05 g/mol. IUPAC: 1,3-dimethyl-2-sulfanylidenequinazolin-4-one.
Chemical Property Profile of 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-
Property Insights of 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-. With a topological polar surface area (TPSA) of 55.6 Ų, 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- has 0 hydrogen bond donor(s) and 2 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 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-?
The CAS number of 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- is 17730-53-9.
What is the molecular formula of 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-?
The molecular formula of 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- is C10H10N2OS.
What is the molecular weight of 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-?
The molecular weight of 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- is 206.05 g/mol.
Where can I buy 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-?
You can request a quote for 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 4(1H)-Quinazolinone, 2,3-dihydro-1,3-dimethyl-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.