N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
Compound characteristics
| Compound ID: | F809-0718 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide |
| Molecular Weight: | 441.46 |
| Molecular Formula: | C21 H19 N3 O6 S |
| Smiles: | Cc1cccc(c1)S(C1C=CC(N(CC(Nc2ccc3c(c2)OCCO3)=O)N=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4516 |
| logD: | 1.4516 |
| logSw: | -2.6304 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.076 |
| InChI Key: | HNSVURSPBJPXNH-UHFFFAOYSA-N |