2-(azepan-1-yl)-1-{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(azepan-1-yl)-1-{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-1,4-diazepan-1-yl}ethan-1-one
2-(azepan-1-yl)-1-{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | SC19-0411 |
| Compound Name: | 2-(azepan-1-yl)-1-{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 403.57 |
| Molecular Formula: | C22 H37 N5 O2 |
| Smiles: | CCn1c2CCOCc2c(CN2CCCN(CC2)C(CN2CCCCCC2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.6953 |
| logD: | -3.513 |
| logSw: | -0.2603 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.845 |
| InChI Key: | AYRDYWZCDVVJKG-UHFFFAOYSA-N |