ethyl 4-[2-{[(2-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-{[(2-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]piperidine-1-carboxylate
ethyl 4-[2-{[(2-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | K284-4587 |
| Compound Name: | ethyl 4-[2-{[(2-chlorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]piperidine-1-carboxylate |
| Molecular Weight: | 457.98 |
| Molecular Formula: | C23 H24 Cl N3 O3 S |
| Smiles: | CCOC(N1CCC(CC1)N1C(=Nc2ccccc2C1=O)SCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8449 |
| logD: | 4.8449 |
| logSw: | -4.824 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.773 |
| InChI Key: | BMOKZBWVPDFTDJ-UHFFFAOYSA-N |