2-(diethylamino)ethyl 4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzoate
Chemical Structure Depiction of
2-(diethylamino)ethyl 4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzoate
2-(diethylamino)ethyl 4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzoate
Compound characteristics
| Compound ID: | K284-0223 |
| Compound Name: | 2-(diethylamino)ethyl 4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzoate |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | CCN(CC)CCOC(c1ccc(cc1)N1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7881 |
| logD: | 2.8198 |
| logSw: | -3.8688 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.165 |
| InChI Key: | ITXXIEPMJPVYME-UHFFFAOYSA-N |