N-cyclopentyl-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-cyclopentyl-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide
N-cyclopentyl-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | K284-4508 |
| Compound Name: | N-cyclopentyl-2-[(4-oxo-3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 587.79 |
| Molecular Formula: | C33 H41 N5 O3 S |
| Smiles: | C1CCC(C1)NC(CSC1=Nc2ccccc2C(N1CC1CCC(CC1)C(N1CCN(CC1)c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9096 |
| logD: | 4.9096 |
| logSw: | -4.8069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.435 |
| InChI Key: | WSAGSSQZLDOTEC-UHFFFAOYSA-N |