3-chloro-4-fluoro-N-{2-[3-(morpholine-4-carbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}benzamide
Chemical Structure Depiction of
3-chloro-4-fluoro-N-{2-[3-(morpholine-4-carbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}benzamide
3-chloro-4-fluoro-N-{2-[3-(morpholine-4-carbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | SD31-0135 |
| Compound Name: | 3-chloro-4-fluoro-N-{2-[3-(morpholine-4-carbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}benzamide |
| Molecular Weight: | 436.87 |
| Molecular Formula: | C20 H22 Cl F N4 O4 |
| Smiles: | C1COCc2c(C(N3CCOCC3)=O)nn(CCNC(c3ccc(c(c3)[Cl])F)=O)c12 |
| Stereo: | ACHIRAL |
| logP: | 0.5376 |
| logD: | 0.5376 |
| logSw: | -2.7033 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.087 |
| InChI Key: | VMZRTNKFVJUOBN-UHFFFAOYSA-N |