3-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0124 |
| Compound Name: | 3-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 376.86 |
| Molecular Formula: | C18 H17 Cl N2 O3 S |
| Smiles: | COc1cc2C(N(CCc3ccc(cc3)[Cl])C(Nc2cc1OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7334 |
| logD: | 3.6726 |
| logSw: | -4.3421 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.557 |
| InChI Key: | KKBMHNVZBFZART-UHFFFAOYSA-N |