N-[(2-chlorophenyl)methyl]-4-({4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-3(4H)-yl}methyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-({4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-3(4H)-yl}methyl)cyclohexane-1-carboxamide
N-[(2-chlorophenyl)methyl]-4-({4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-3(4H)-yl}methyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K284-4509 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-({4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-3(4H)-yl}methyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 560.12 |
| Molecular Formula: | C31 H30 Cl N3 O3 S |
| Smiles: | C1CC(CCC1CN1C(=Nc2ccccc2C1=O)SCC(c1ccccc1)=O)C(NCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7248 |
| logD: | 5.7248 |
| logSw: | -5.8681 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.623 |
| InChI Key: | RUEMFHKHHAQFNF-UHFFFAOYSA-N |