(azepan-1-yl)[3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone
(azepan-1-yl)[3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone
Compound characteristics
| Compound ID: | E751-3889 |
| Compound Name: | (azepan-1-yl)[3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C22 H26 N4 O |
| Smiles: | Cc1ccc(cc1)n1c(c(C(N2CCCCCC2)=O)c(C)n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3378 |
| logD: | 4.3378 |
| logSw: | -4.3346 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.427 |
| InChI Key: | ISVBDFUVBDIODZ-UHFFFAOYSA-N |