N-tert-butyl-5-[4-(2,5-dimethylanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-tert-butyl-5-[4-(2,5-dimethylanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
N-tert-butyl-5-[4-(2,5-dimethylanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
Compound characteristics
Compound ID: | 4109-1962 |
Compound Name: | N-tert-butyl-5-[4-(2,5-dimethylanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide |
Molecular Weight: | 474.62 |
Molecular Formula: | C27 H30 N4 O2 S |
Smiles: | Cc1ccc(C)c(c1)Nc1c2ccccc2c(c2ccc(C)c(c2)S(NC(C)(C)C)(=O)=O)nn1 |
Stereo: | ACHIRAL |
logP: | 5.7296 |
logD: | 5.7253 |
logSw: | -5.8088 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.13 |
InChI Key: | CXIUVYRMTPJIKG-UHFFFAOYSA-N |