4-[1-(3,4-dimethylbenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]morpholine
Chemical Structure Depiction of
4-[1-(3,4-dimethylbenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]morpholine
4-[1-(3,4-dimethylbenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]morpholine
Compound characteristics
Compound ID: | G680-0664 |
Compound Name: | 4-[1-(3,4-dimethylbenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]morpholine |
Molecular Weight: | 413.51 |
Molecular Formula: | C17 H23 N3 O5 S2 |
Smiles: | Cc1ccc(cc1C)S(n1c(C)c(c(C)n1)S(N1CCOCC1)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.7307 |
logD: | 1.7307 |
logSw: | -2.3944 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 80.478 |
InChI Key: | NJZOVFHPCWWKDI-UHFFFAOYSA-N |