1-(6-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropylpiperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropylpiperidine-4-carboxamide
1-(6-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0995 |
| Compound Name: | 1-(6-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropylpiperidine-4-carboxamide |
| Molecular Weight: | 476 |
| Molecular Formula: | C22 H26 Cl N5 O3 S |
| Smiles: | COc1ccc(cc1NC(CSc1cc(ncn1)N1CCC(CC1)C(NC1CC1)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2081 |
| logD: | 3.2039 |
| logSw: | -3.5191 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.605 |
| InChI Key: | ZAMFPHOXBJCMPJ-UHFFFAOYSA-N |