N-[(3-chlorophenyl)methyl]-3-cyclohexyl-2-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-3-cyclohexyl-2-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-[(3-chlorophenyl)methyl]-3-cyclohexyl-2-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-3911 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-3-cyclohexyl-2-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 553.12 |
| Molecular Formula: | C29 H33 Cl N4 O3 S |
| Smiles: | C1CCC(CC1)N1C(=Nc2cc(ccc2C1=O)C(NCc1cccc(c1)[Cl])=O)SCC(NC1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1913 |
| logD: | 5.1912 |
| logSw: | -5.5922 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.969 |
| InChI Key: | WIJIGCMKUDIPKQ-UHFFFAOYSA-N |