N-cyclopropyl-1-(6-{[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-1-(6-{[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
N-cyclopropyl-1-(6-{[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-1685 |
| Compound Name: | N-cyclopropyl-1-(6-{[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 471.64 |
| Molecular Formula: | C23 H29 N5 O2 S2 |
| Smiles: | CSc1ccc(CNC(CSc2cc(ncn2)N2CCC(CC2)C(NC2CC2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3558 |
| logD: | 3.3558 |
| logSw: | -3.5607 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.995 |
| InChI Key: | SPPACXDDTCLNMJ-UHFFFAOYSA-N |