N-[(4-methylphenyl)methyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide
N-[(4-methylphenyl)methyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide
Compound characteristics
| Compound ID: | K297-1029 |
| Compound Name: | N-[(4-methylphenyl)methyl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanamide |
| Molecular Weight: | 394.54 |
| Molecular Formula: | C22 H26 N4 O S |
| Smiles: | Cc1ccc(CNC(CCCCCNC2c3ccccc3NC(N=2)=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2732 |
| logD: | 2.1753 |
| logSw: | -3.6354 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 55.375 |
| InChI Key: | KUVNBXLFUYFDKH-UHFFFAOYSA-N |