1-(2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carbonyl)piperidine-4-carboxamide
1-(2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K284-4528 |
| Compound Name: | 1-(2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 537.04 |
| Molecular Formula: | C27 H25 Cl N4 O4 S |
| Smiles: | C1CN(CCC1C(N)=O)C(c1ccc2C(N(Cc3ccco3)C(=Nc2c1)SCc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2084 |
| logD: | 3.2084 |
| logSw: | -3.7035 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.227 |
| InChI Key: | PYEXYPHAPMHQSK-UHFFFAOYSA-N |