2-(azepan-1-yl)-1-[1'-methyl-3'-(pyrrolidine-1-carbonyl)-4',7'-dihydro-1'H-spiro[piperidine-4,6'-pyrano[4,3-c]pyrazol]-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(azepan-1-yl)-1-[1'-methyl-3'-(pyrrolidine-1-carbonyl)-4',7'-dihydro-1'H-spiro[piperidine-4,6'-pyrano[4,3-c]pyrazol]-1-yl]ethan-1-one
2-(azepan-1-yl)-1-[1'-methyl-3'-(pyrrolidine-1-carbonyl)-4',7'-dihydro-1'H-spiro[piperidine-4,6'-pyrano[4,3-c]pyrazol]-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | SC73-1321 |
| Compound Name: | 2-(azepan-1-yl)-1-[1'-methyl-3'-(pyrrolidine-1-carbonyl)-4',7'-dihydro-1'H-spiro[piperidine-4,6'-pyrano[4,3-c]pyrazol]-1-yl]ethan-1-one |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C24 H37 N5 O3 |
| Smiles: | Cn1c2CC3(CCN(CC3)C(CN3CCCCCC3)=O)OCc2c(C(N2CCCC2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.1393 |
| logD: | 0.5666 |
| logSw: | -1.185 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.555 |
| InChI Key: | HJZHECOICDYVDD-UHFFFAOYSA-N |