ethyl 1-(3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-methylpyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-methylpyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-4-carboxylate
ethyl 1-(3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-methylpyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V015-5359 |
| Compound Name: | ethyl 1-(3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-methylpyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-4-carboxylate |
| Molecular Weight: | 592.76 |
| Molecular Formula: | C32 H40 N4 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)C(c1cccc(CSc2nc(C)cc(n2)N(C)CCc2ccc(c(c2)OC)OC)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6068 |
| logD: | 4.6032 |
| logSw: | -4.4436 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.126 |
| InChI Key: | XNRPPLQCLDSQML-UHFFFAOYSA-N |