N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | E851-1856 |
| Compound Name: | N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 452.64 |
| Molecular Formula: | C26 H40 N6 O |
| Smiles: | C1CCCC2=C(CC1)C=Nc1c(cnn12)C(NCCCN1CCN(CC1)C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.906 |
| logD: | 2.9956 |
| logSw: | -3.7879 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.063 |
| InChI Key: | JUBMFWKQRKCSAP-UHFFFAOYSA-N |