N-tert-butyl-2-methyl-5-[4-(4-sulfamoylanilino)phthalazin-1-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-tert-butyl-2-methyl-5-[4-(4-sulfamoylanilino)phthalazin-1-yl]benzene-1-sulfonamide
N-tert-butyl-2-methyl-5-[4-(4-sulfamoylanilino)phthalazin-1-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4109-1966 |
| Compound Name: | N-tert-butyl-2-methyl-5-[4-(4-sulfamoylanilino)phthalazin-1-yl]benzene-1-sulfonamide |
| Molecular Weight: | 525.65 |
| Molecular Formula: | C25 H27 N5 O4 S2 |
| Smiles: | Cc1ccc(cc1S(NC(C)(C)C)(=O)=O)c1c2ccccc2c(Nc2ccc(cc2)S(N)(=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.7322 |
| logD: | 3.7308 |
| logSw: | -4.1815 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 123.431 |
| InChI Key: | YDEDQIKUUQNOAK-UHFFFAOYSA-N |