1-(6-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-ethylpiperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-ethylpiperidine-4-carboxamide
1-(6-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-ethylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-1349 |
| Compound Name: | 1-(6-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-ethylpiperidine-4-carboxamide |
| Molecular Weight: | 463.99 |
| Molecular Formula: | C21 H26 Cl N5 O3 S |
| Smiles: | CCNC(C1CCN(CC1)c1cc(ncn1)SCC(Nc1cc(ccc1OC)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0951 |
| logD: | 3.0909 |
| logSw: | -3.4152 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.446 |
| InChI Key: | WVHMCVRZOSLBIJ-UHFFFAOYSA-N |