7-chloro-3-[(4-fluorophenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
7-chloro-3-[(4-fluorophenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
7-chloro-3-[(4-fluorophenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0342 |
| Compound Name: | 7-chloro-3-[(4-fluorophenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 320.77 |
| Molecular Formula: | C15 H10 Cl F N2 O S |
| Smiles: | C(c1ccc(cc1)F)N1C(c2ccc(cc2NC1=S)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.983 |
| logD: | 3.9569 |
| logSw: | -4.4164 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.3179 |
| InChI Key: | MTAGHPPQGGJQDL-UHFFFAOYSA-N |