3-chloro-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}benzamide
Chemical Structure Depiction of
3-chloro-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}benzamide
3-chloro-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}benzamide
Compound characteristics
| Compound ID: | T479-0405 |
| Compound Name: | 3-chloro-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}benzamide |
| Molecular Weight: | 400.89 |
| Molecular Formula: | C18 H17 Cl N6 O S |
| Smiles: | C1CSCCN1c1cncnc1n1cc(cn1)NC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6876 |
| logD: | 2.6843 |
| logSw: | -3.5096 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.052 |
| InChI Key: | GXIIGZFCIBUZAD-UHFFFAOYSA-N |