(2H-1,3-benzodioxol-5-yl)[3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)[3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
(2H-1,3-benzodioxol-5-yl)[3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
Compound characteristics
| Compound ID: | G680-0179 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)[3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone |
| Molecular Weight: | 391.44 |
| Molecular Formula: | C18 H21 N3 O5 S |
| Smiles: | Cc1c(c(C)n(C(c2ccc3c(c2)OCO3)=O)n1)S(N1CCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4859 |
| logD: | 1.4859 |
| logSw: | -2.3816 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.679 |
| InChI Key: | LLKUHMXNOHKJRE-UHFFFAOYSA-N |