N-cyclopropyl-1-(6-{[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-1-(6-{[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
N-cyclopropyl-1-(6-{[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0917 |
| Compound Name: | N-cyclopropyl-1-(6-{[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C23 H29 N5 O3 S |
| Smiles: | CCOc1ccccc1NC(CSc1cc(ncn1)N1CCC(CC1)C(NC1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1298 |
| logD: | 3.1297 |
| logSw: | -3.3054 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.185 |
| InChI Key: | KOZNETVHLNUQQA-UHFFFAOYSA-N |