N-(4-methylcyclohexyl)-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-(4-methylcyclohexyl)-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
N-(4-methylcyclohexyl)-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | K284-4411 |
| Compound Name: | N-(4-methylcyclohexyl)-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide |
| Molecular Weight: | 407.53 |
| Molecular Formula: | C23 H25 N3 O2 S |
| Smiles: | CC1CCC(CC1)NC(c1ccc(CN2C(c3ccccc3NC2=S)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0973 |
| logD: | 5.0969 |
| logSw: | -4.7477 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.457 |
| InChI Key: | YJUAIVFTOJSFJD-UHFFFAOYSA-N |