N-[(1H-benzimidazol-2-yl)methyl]-5-[4-(4-hydroxyanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(1H-benzimidazol-2-yl)methyl]-5-[4-(4-hydroxyanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
N-[(1H-benzimidazol-2-yl)methyl]-5-[4-(4-hydroxyanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4903-2136 |
| Compound Name: | N-[(1H-benzimidazol-2-yl)methyl]-5-[4-(4-hydroxyanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 536.61 |
| Molecular Formula: | C29 H24 N6 O3 S |
| Smiles: | Cc1ccc(cc1S(NCc1nc2ccccc2[nH]1)(=O)=O)c1c2ccccc2c(Nc2ccc(cc2)O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 5.2503 |
| logD: | 5.1355 |
| logSw: | -5.0525 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 111.418 |
| InChI Key: | KQVWJGDQZXONDN-UHFFFAOYSA-N |