(azepan-1-yl)(1,3,5-trimethyl-1H-pyrazol-4-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(1,3,5-trimethyl-1H-pyrazol-4-yl)methanone
(azepan-1-yl)(1,3,5-trimethyl-1H-pyrazol-4-yl)methanone
Compound characteristics
| Compound ID: | Y502-2989 |
| Compound Name: | (azepan-1-yl)(1,3,5-trimethyl-1H-pyrazol-4-yl)methanone |
| Molecular Weight: | 235.33 |
| Molecular Formula: | C13 H21 N3 O |
| Smiles: | Cc1c(C(N2CCCCCC2)=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.1123 |
| logD: | 1.1123 |
| logSw: | -1.1075 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 32.057 |
| InChI Key: | VPFYUMVBNNYCPW-UHFFFAOYSA-N |