(2H-1,3-benzodioxol-5-yl)[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
(2H-1,3-benzodioxol-5-yl)[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
Compound characteristics
| Compound ID: | G680-0178 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone |
| Molecular Weight: | 377.42 |
| Molecular Formula: | C17 H19 N3 O5 S |
| Smiles: | Cc1c(c(C)n(C(c2ccc3c(c2)OCO3)=O)n1)S(N1CCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1554 |
| logD: | 1.1554 |
| logSw: | -2.336 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.045 |
| InChI Key: | ZLVCMXPFNRDACY-UHFFFAOYSA-N |