N-[(4-methylphenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
N-[(4-methylphenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Compound characteristics
| Compound ID: | K284-1148 |
| Compound Name: | N-[(4-methylphenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide |
| Molecular Weight: | 395.52 |
| Molecular Formula: | C22 H25 N3 O2 S |
| Smiles: | Cc1ccc(CNC(CCCCCN2C(c3ccccc3NC2=S)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7821 |
| logD: | 3.781 |
| logSw: | -3.8285 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.768 |
| InChI Key: | SSADKPBGDDQGMZ-UHFFFAOYSA-N |