N-tert-butyl-5-[4-(3-chloroanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-tert-butyl-5-[4-(3-chloroanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
N-tert-butyl-5-[4-(3-chloroanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4109-1973 |
| Compound Name: | N-tert-butyl-5-[4-(3-chloroanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 481.02 |
| Molecular Formula: | C25 H25 Cl N4 O2 S |
| Smiles: | Cc1ccc(cc1S(NC(C)(C)C)(=O)=O)c1c2ccccc2c(Nc2cccc(c2)[Cl])nn1 |
| Stereo: | ACHIRAL |
| logP: | 6.1251 |
| logD: | 6.124 |
| logSw: | -6.3323 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.828 |
| InChI Key: | CZMWQXTVRLEREW-UHFFFAOYSA-N |