N-[(4-methylphenyl)methyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-[(4-methylphenyl)methyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | E851-1699 |
| Compound Name: | N-[(4-methylphenyl)methyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 348.45 |
| Molecular Formula: | C21 H24 N4 O |
| Smiles: | Cc1ccc(CNC(c2cnn3C4CCCCCCC=4C=Nc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3815 |
| logD: | 4.3813 |
| logSw: | -4.112 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.146 |
| InChI Key: | DBTWUBICDJVUCP-UHFFFAOYSA-N |