3-chloro-4-fluoro-N-{2-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]ethyl}benzamide
Chemical Structure Depiction of
3-chloro-4-fluoro-N-{2-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]ethyl}benzamide
3-chloro-4-fluoro-N-{2-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | SA55-1821 |
| Compound Name: | 3-chloro-4-fluoro-N-{2-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]ethyl}benzamide |
| Molecular Weight: | 365.83 |
| Molecular Formula: | C18 H21 Cl F N3 O2 |
| Smiles: | CC(C)n1c2CCOCc2c(CCNC(c2ccc(c(c2)[Cl])F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3066 |
| logD: | 2.3066 |
| logSw: | -3.497 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.516 |
| InChI Key: | XNKOSAIUULNHRZ-UHFFFAOYSA-N |