N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methylbenzene-1-sulfonyl)hydrazinylidene]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methylbenzene-1-sulfonyl)hydrazinylidene]-2H-1-benzopyran-3-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methylbenzene-1-sulfonyl)hydrazinylidene]-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | C635-0120 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methylbenzene-1-sulfonyl)hydrazinylidene]-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 491.52 |
| Molecular Formula: | C25 H21 N3 O6 S |
| Smiles: | Cc1ccc(cc1)S(N/N=C1/C(=Cc2ccccc2O1)C(Nc1ccc2c(c1)OCCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3269 |
| logD: | 0.0723 |
| logSw: | -3.8427 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.28 |
| InChI Key: | RONVERZZMGLXSA-UHFFFAOYSA-N |