5-(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)-N-(3-fluorophenyl)-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
5-(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)-N-(3-fluorophenyl)-2-methylbenzene-1-sulfonamide
5-(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)-N-(3-fluorophenyl)-2-methylbenzene-1-sulfonamide
Compound characteristics
Compound ID: | D505-0309 |
Compound Name: | 5-(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)-N-(3-fluorophenyl)-2-methylbenzene-1-sulfonamide |
Molecular Weight: | 441.52 |
Molecular Formula: | C23 H24 F N3 O3 S |
Smiles: | CCN1C(C2CCCCC=2C(c2ccc(C)c(c2)S(Nc2cccc(c2)F)(=O)=O)=N1)=O |
Stereo: | ACHIRAL |
logP: | 5.0763 |
logD: | 3.8759 |
logSw: | -4.7101 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.033 |
InChI Key: | QSQOTEJPQRDSFQ-UHFFFAOYSA-N |