ethyl 1-{4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
ethyl 1-{4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V025-5304 |
| Compound Name: | ethyl 1-{4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-4-carboxylate |
| Molecular Weight: | 524.73 |
| Molecular Formula: | C29 H40 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(N1CCC(CC1)C(=O)OCC)=O)N(C)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.3862 |
| logD: | 5.3858 |
| logSw: | -5.1538 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.627 |
| InChI Key: | RGFHJMAXLCDCGN-UHFFFAOYSA-N |