6-chloro-3-[2-(4-chlorophenyl)ethyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6-chloro-3-[2-(4-chlorophenyl)ethyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6-chloro-3-[2-(4-chlorophenyl)ethyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0574 |
| Compound Name: | 6-chloro-3-[2-(4-chlorophenyl)ethyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 351.25 |
| Molecular Formula: | C16 H12 Cl2 N2 O S |
| Smiles: | C(CN1C(c2cc(ccc2NC1=S)[Cl])=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7962 |
| logD: | 4.6292 |
| logSw: | -4.8674 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.2963 |
| InChI Key: | LUYJKQJYCICKEQ-UHFFFAOYSA-N |