N-[(2-bromophenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-[(2-bromophenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | E851-1450 |
| Compound Name: | N-[(2-bromophenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 399.29 |
| Molecular Formula: | C19 H19 Br N4 O |
| Smiles: | C1CCC2C=Nc3c(cnn3C=2CC1)C(NCc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3342 |
| logD: | 4.334 |
| logSw: | -4.1727 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.146 |
| InChI Key: | BFYQFSFZZCWQME-UHFFFAOYSA-N |