ethyl 1-{4-[({4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[({4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
ethyl 1-{4-[({4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V026-6049 |
| Compound Name: | ethyl 1-{4-[({4-(methoxymethyl)-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate |
| Molecular Weight: | 500.66 |
| Molecular Formula: | C26 H36 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCN(C)c1cc(COC)nc(n1)SCc1ccc(cc1)C(N1CCC(CC1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6998 |
| logD: | 3.6974 |
| logSw: | -3.8531 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.249 |
| InChI Key: | DTFYMEIFSDBJOF-UHFFFAOYSA-N |