5-[4-(3-chloroanilino)phthalazin-1-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
5-[4-(3-chloroanilino)phthalazin-1-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzene-1-sulfonamide
5-[4-(3-chloroanilino)phthalazin-1-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8012-7574 |
| Compound Name: | 5-[4-(3-chloroanilino)phthalazin-1-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 617.17 |
| Molecular Formula: | C33 H33 Cl N4 O4 S |
| Smiles: | CCOc1ccc(CCNS(c2cc(ccc2C)c2c3ccccc3c(Nc3cccc(c3)[Cl])nn2)(=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 6.9805 |
| logD: | 6.98 |
| logSw: | -6.5006 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.781 |
| InChI Key: | IPSZIQRKQOPXGC-UHFFFAOYSA-N |