1-[1-(methanesulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]azepane
Chemical Structure Depiction of
1-[1-(methanesulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]azepane
1-[1-(methanesulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]azepane
Compound characteristics
| Compound ID: | G680-0505 |
| Compound Name: | 1-[1-(methanesulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]azepane |
| Molecular Weight: | 335.44 |
| Molecular Formula: | C12 H21 N3 O4 S2 |
| Smiles: | Cc1c(c(C)n(n1)S(C)(=O)=O)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5546 |
| logD: | 0.5546 |
| logSw: | -1.1826 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.665 |
| InChI Key: | QASGVWPRZZLISO-UHFFFAOYSA-N |