ethyl 1-{3-[({4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[({4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
ethyl 1-{3-[({4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V019-1547 |
| Compound Name: | ethyl 1-{3-[({4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate |
| Molecular Weight: | 470.63 |
| Molecular Formula: | C25 H34 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCCN(C)c1cc(C)nc(n1)SCc1cccc(c1)C(N1CCC(CC1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1298 |
| logD: | 4.1263 |
| logSw: | -4.0842 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.137 |
| InChI Key: | GHILOWUIOPKFGB-UHFFFAOYSA-N |