5-[4-(4-fluoroanilino)phthalazin-1-yl]-N-(2-hydroxyethyl)-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
5-[4-(4-fluoroanilino)phthalazin-1-yl]-N-(2-hydroxyethyl)-2-methylbenzene-1-sulfonamide
5-[4-(4-fluoroanilino)phthalazin-1-yl]-N-(2-hydroxyethyl)-2-methylbenzene-1-sulfonamide
Compound characteristics
Compound ID: | 4903-2249 |
Compound Name: | 5-[4-(4-fluoroanilino)phthalazin-1-yl]-N-(2-hydroxyethyl)-2-methylbenzene-1-sulfonamide |
Molecular Weight: | 452.51 |
Molecular Formula: | C23 H21 F N4 O3 S |
Smiles: | Cc1ccc(cc1S(NCCO)(=O)=O)c1c2ccccc2c(Nc2ccc(cc2)F)nn1 |
Stereo: | ACHIRAL |
logP: | 3.8946 |
logD: | 3.8938 |
logSw: | -4.0304 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 90.288 |
InChI Key: | IEUSHOFJHBEQFY-UHFFFAOYSA-N |