2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | Y509-0229 |
| Compound Name: | 2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 323.44 |
| Molecular Formula: | C19 H25 N5 |
| Smiles: | CCn1c(C)c(c2c3CCCCCCc3nc(c2C#N)N)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.059 |
| logD: | 3.0543 |
| logSw: | -3.0529 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.366 |
| InChI Key: | XMLJPWDCHAOHIJ-UHFFFAOYSA-N |