F0581-0589
TL;DR: F0581-0589 (CAS 433969-01-8) is a chemical compound with molecular formula C17H20N2O2S and molecular weight 316.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-methoxyphenyl)-7,7-dimethyl-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinazolin-5-one
Also Known As: F0581-0589, 4-(2-methoxyphenyl)-7,7-dimethyl-2-sulfanylidene-1,2,3,4,5,6,7,8-octahydroquinazolin-5-one, 4-(2-methoxyphenyl)-7,7-dimethyl-2-thioxo-1,2,3,4,7,8-hexahydroquinazolin-5(6H)-one, 4-(2-methoxyphenyl)-7,7-dimethyl-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinazolin-5-one
| Molecular Formula | C17H20N2O2S |
|---|---|
| Molecular Weight | 316.12 g/mol |
| LogP | 2.8572 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.12454 |
| Heavy Atoms | 22 |
| Complexity | 678.99146 |
Chemical Identifiers
| CAS Number | 433969-01-8 |
|---|---|
| SMILES | CC1(CC2=C(C(NC(=S)N2)C3=CC=CC=C3OC)C(=O)C1)C |
Product Overview
F0581-0589 (CAS 433969-01-8), with molecular formula C17H20N2O2S and molecular weight 316.12 g/mol. IUPAC: 4-(2-methoxyphenyl)-7,7-dimethyl-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinazolin-5-one.
Chemical Property Profile of F0581-0589
Property Insights of F0581-0589
The XLogP value of 2.8572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0581-0589. With a topological polar surface area (TPSA) of 50.36 Ų, F0581-0589 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0581-0589 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 F0581-0589?
The CAS number of F0581-0589 is 433969-01-8.
What is the molecular formula of F0581-0589?
The molecular formula of F0581-0589 is C17H20N2O2S.
What is the molecular weight of F0581-0589?
The molecular weight of F0581-0589 is 316.12 g/mol.
Where can I buy F0581-0589?
You can request a quote for F0581-0589 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0581-0589?
Yes, KEHONG BIO provides custom synthesis services for F0581-0589 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.