ethyl 1-{2-(3-methylphenyl)-4-[methyl(phenyl)amino]pyrimidine-5-carbonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-(3-methylphenyl)-4-[methyl(phenyl)amino]pyrimidine-5-carbonyl}piperidine-4-carboxylate
ethyl 1-{2-(3-methylphenyl)-4-[methyl(phenyl)amino]pyrimidine-5-carbonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V026-8898 |
| Compound Name: | ethyl 1-{2-(3-methylphenyl)-4-[methyl(phenyl)amino]pyrimidine-5-carbonyl}piperidine-4-carboxylate |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)C(c1cnc(c2cccc(C)c2)nc1N(C)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4811 |
| logD: | 4.4286 |
| logSw: | -4.2209 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.568 |
| InChI Key: | HGKRHBAWERLZGF-UHFFFAOYSA-N |