N-(3-chloro-4-methylphenyl)-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanamide
N-(3-chloro-4-methylphenyl)-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanamide
Compound characteristics
| Compound ID: | K284-2762 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanamide |
| Molecular Weight: | 387.89 |
| Molecular Formula: | C19 H18 Cl N3 O2 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CCCN1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0386 |
| logD: | 4.0375 |
| logSw: | -4.322 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.446 |
| InChI Key: | MPNJZJKILGMVPV-UHFFFAOYSA-N |