N-(4-bromo-3-methylphenyl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
N-(4-bromo-3-methylphenyl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
Compound characteristics
| Compound ID: | F809-0753 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide |
| Molecular Weight: | 476.35 |
| Molecular Formula: | C20 H18 Br N3 O4 S |
| Smiles: | Cc1cccc(c1)S(C1C=CC(N(CC(Nc2ccc(c(C)c2)[Br])=O)N=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6536 |
| logD: | 3.6536 |
| logSw: | -3.8856 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.253 |
| InChI Key: | HWOAOXXBOBSBOL-UHFFFAOYSA-N |