N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-bromobenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-bromobenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-bromobenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
Compound characteristics
| Compound ID: | F809-0218 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-bromobenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide |
| Molecular Weight: | 492.3 |
| Molecular Formula: | C19 H14 Br N3 O6 S |
| Smiles: | C(C(Nc1ccc2c(c1)OCO2)=O)N1C(C=CC(=N1)S(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8571 |
| logD: | 2.8571 |
| logSw: | -3.4085 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.368 |
| InChI Key: | KXVAASCKCZZBPF-UHFFFAOYSA-N |