3-benzyl-7-chloro-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-benzyl-7-chloro-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-benzyl-7-chloro-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-0525 |
| Compound Name: | 3-benzyl-7-chloro-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 302.78 |
| Molecular Formula: | C15 H11 Cl N2 O S |
| Smiles: | C(c1ccccc1)N1C(c2ccc(cc2NC1=S)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.954 |
| logD: | 3.9279 |
| logSw: | -4.4013 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.3179 |
| InChI Key: | LAADWZIYYAUINP-UHFFFAOYSA-N |