5-[4-(4-bromoanilino)phthalazin-1-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
5-[4-(4-bromoanilino)phthalazin-1-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzene-1-sulfonamide
5-[4-(4-bromoanilino)phthalazin-1-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8012-7577 |
| Compound Name: | 5-[4-(4-bromoanilino)phthalazin-1-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 661.62 |
| Molecular Formula: | C33 H33 Br N4 O4 S |
| Smiles: | CCOc1ccc(CCNS(c2cc(ccc2C)c2c3ccccc3c(Nc3ccc(cc3)[Br])nn2)(=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 7.0608 |
| logD: | 7.0603 |
| logSw: | -5.9912 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.781 |
| InChI Key: | LODIBHDKOOBZRI-UHFFFAOYSA-N |