N-cyclopropyl-1-(6-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-1-(6-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
N-cyclopropyl-1-(6-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0913 |
| Compound Name: | N-cyclopropyl-1-(6-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 471.58 |
| Molecular Formula: | C23 H29 N5 O4 S |
| Smiles: | COc1ccc(c(c1)NC(CSc1cc(ncn1)N1CCC(CC1)C(NC1CC1)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.6386 |
| logD: | 2.6381 |
| logSw: | -3.1682 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.149 |
| InChI Key: | NNUPHOCHCRUQQQ-UHFFFAOYSA-N |