N-(2-chloro-4-methylphenyl)-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-(2-chloro-4-methylphenyl)-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | E851-1720 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 368.86 |
| Molecular Formula: | C20 H21 Cl N4 O |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(c1cnn2C3CCCCCCC=3C=Nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9165 |
| logD: | 4.8437 |
| logSw: | -4.8144 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.126 |
| InChI Key: | QKCNVVZWLVYLBX-UHFFFAOYSA-N |