2-chloro-5-(methylsulfanyl)-N-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}benzamide
Chemical Structure Depiction of
2-chloro-5-(methylsulfanyl)-N-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}benzamide
2-chloro-5-(methylsulfanyl)-N-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}benzamide
Compound characteristics
| Compound ID: | P431-0201 |
| Compound Name: | 2-chloro-5-(methylsulfanyl)-N-{1-[5-(pyrrolidin-1-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}benzamide |
| Molecular Weight: | 414.91 |
| Molecular Formula: | C19 H19 Cl N6 O S |
| Smiles: | CSc1ccc(c(c1)C(Nc1cnn(c1)c1ncc(cn1)N1CCCC1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3294 |
| logD: | 3.3278 |
| logSw: | -3.7261 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.047 |
| InChI Key: | HWPNJGGQSMAMFX-UHFFFAOYSA-N |