N-[2-(4-chlorophenyl)ethyl]-7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-[2-(4-chlorophenyl)ethyl]-7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | E851-1350 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 368.86 |
| Molecular Formula: | C20 H21 Cl N4 O |
| Smiles: | C1CCC2C=Nc3c(cnn3C=2CC1)C(NCCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9905 |
| logD: | 3.9905 |
| logSw: | -4.5617 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.987 |
| InChI Key: | SITJUJQJMKXTDM-UHFFFAOYSA-N |