N-[2-(3,4-dimethoxyphenyl)ethyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | E851-1686 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6,7,8,9,10,11-hexahydrocycloocta[e]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 408.5 |
| Molecular Formula: | C23 H28 N4 O3 |
| Smiles: | COc1ccc(CCNC(c2cnn3C4CCCCCCC=4C=Nc23)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.4088 |
| logD: | 3.4087 |
| logSw: | -3.5804 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.248 |
| InChI Key: | PHLXXLMCZZRYDO-UHFFFAOYSA-N |