N-[(4-methylphenyl)methyl]-4-{[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]methyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-4-{[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]methyl}cyclohexane-1-carboxamide
N-[(4-methylphenyl)methyl]-4-{[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]methyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K297-0959 |
| Compound Name: | N-[(4-methylphenyl)methyl]-4-{[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]methyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 420.58 |
| Molecular Formula: | C24 H28 N4 O S |
| Smiles: | Cc1ccc(CNC(C2CCC(CC2)CNC2c3ccccc3NC(N=2)=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1762 |
| logD: | 3.6286 |
| logSw: | -4.3498 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 55.667 |
| InChI Key: | YPFFKGCYPBUTRW-UHFFFAOYSA-N |