1-(6-{[2-(2-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropylpiperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-{[2-(2-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropylpiperidine-4-carboxamide
1-(6-{[2-(2-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0991 |
| Compound Name: | 1-(6-{[2-(2-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropylpiperidine-4-carboxamide |
| Molecular Weight: | 460 |
| Molecular Formula: | C22 H26 Cl N5 O2 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CSc1cc(ncn1)N1CCC(CC1)C(NC1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.679 |
| logD: | 3.6788 |
| logSw: | -3.7707 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.975 |
| InChI Key: | NQICXEDPNDHYOS-UHFFFAOYSA-N |