N-cyclopropyl-1-[6-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-1-[6-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
N-cyclopropyl-1-[6-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0922 |
| Compound Name: | N-cyclopropyl-1-[6-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide |
| Molecular Weight: | 457.62 |
| Molecular Formula: | C22 H27 N5 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(CSc1cc(ncn1)N1CCC(CC1)C(NC1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4162 |
| logD: | 3.4161 |
| logSw: | -3.7534 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.673 |
| InChI Key: | QOGGVYQSUYCKIM-UHFFFAOYSA-N |