N-[2-(4-chlorophenyl)ethyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-[2-(4-chlorophenyl)ethyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
Compound ID: | E851-1677 |
Compound Name: | N-[2-(4-chlorophenyl)ethyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
Molecular Weight: | 382.89 |
Molecular Formula: | C21 H23 Cl N4 O |
Smiles: | C1CCCC2=C(CC1)C=Nc1c(cnn12)C(NCCc1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 4.4864 |
logD: | 4.4864 |
logSw: | -4.7297 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.987 |
InChI Key: | YXCNWYZWRVROTB-UHFFFAOYSA-N |