N,N-diethyl-1-(4-methoxy-3-methylbenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-1-(4-methoxy-3-methylbenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
N,N-diethyl-1-(4-methoxy-3-methylbenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
Compound characteristics
Compound ID: | G680-0581 |
Compound Name: | N,N-diethyl-1-(4-methoxy-3-methylbenzene-1-sulfonyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide |
Molecular Weight: | 415.53 |
Molecular Formula: | C17 H25 N3 O5 S2 |
Smiles: | CCN(CC)S(c1c(C)nn(c1C)S(c1ccc(c(C)c1)OC)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.9756 |
logD: | 1.9756 |
logSw: | -2.5176 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 79.586 |
InChI Key: | XETCRBSZRWSLRF-UHFFFAOYSA-N |