4-bromo-2-methyl-N-[2-oxo-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-2-methyl-N-[2-oxo-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
4-bromo-2-methyl-N-[2-oxo-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
Compound ID: | G645-1836 |
Compound Name: | 4-bromo-2-methyl-N-[2-oxo-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
Molecular Weight: | 439.35 |
Molecular Formula: | C17 H15 Br N2 O3 S2 |
Smiles: | Cc1cc(ccc1S(Nc1ccc2c(c1)SC(N2CC=C)=O)(=O)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 4.9935 |
logD: | 4.3819 |
logSw: | -4.5754 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.711 |
InChI Key: | CXVGQUXRYFWYKR-UHFFFAOYSA-N |