3,4-dimethyl-N-[2-oxo-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
3,4-dimethyl-N-[2-oxo-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
3,4-dimethyl-N-[2-oxo-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
Compound ID: | G645-1800 |
Compound Name: | 3,4-dimethyl-N-[2-oxo-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
Molecular Weight: | 374.48 |
Molecular Formula: | C18 H18 N2 O3 S2 |
Smiles: | Cc1ccc(cc1C)S(Nc1ccc2c(c1)SC(N2CC=C)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.7073 |
logD: | 4.6164 |
logSw: | -4.3907 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.711 |
InChI Key: | VNFSGNPMYGSEPX-UHFFFAOYSA-N |