2-(4-chlorophenyl)-1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]azepane
Chemical Structure Depiction of
2-(4-chlorophenyl)-1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]azepane
2-(4-chlorophenyl)-1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]azepane
Compound characteristics
| Compound ID: | J006-1128 |
| Compound Name: | 2-(4-chlorophenyl)-1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]azepane |
| Molecular Weight: | 317.86 |
| Molecular Formula: | C18 H24 Cl N3 |
| Smiles: | Cc1c(CN2CCCCCC2c2ccc(cc2)[Cl])cn(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.737 |
| logD: | 0.0905 |
| logSw: | -4.3945 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 19.0521 |
| InChI Key: | KZGCNJNHFOQXBK-SFHVURJKSA-N |