N-{2-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Chemical Structure Depiction of
N-{2-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
N-{2-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Compound characteristics
| Compound ID: | SA55-1828 |
| Compound Name: | N-{2-[1-(propan-2-yl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
| Molecular Weight: | 371.43 |
| Molecular Formula: | C20 H25 N3 O4 |
| Smiles: | CC(C)n1c2CCOCc2c(CCNC(C2COc3ccccc3O2)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7232 |
| logD: | 1.7232 |
| logSw: | -1.9976 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.953 |
| InChI Key: | YRICJGCZNYDSTK-IBGZPJMESA-N |