N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(3,4-dimethylbenzene-1-sulfonyl)pyridine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(3,4-dimethylbenzene-1-sulfonyl)pyridine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(3,4-dimethylbenzene-1-sulfonyl)pyridine-3-carboxamide
Compound characteristics
| Compound ID: | F800-0383 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(3,4-dimethylbenzene-1-sulfonyl)pyridine-3-carboxamide |
| Molecular Weight: | 424.47 |
| Molecular Formula: | C22 H20 N2 O5 S |
| Smiles: | Cc1ccc(cc1C)S(c1ccc(cn1)C(NCc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8433 |
| logD: | 3.8433 |
| logSw: | -3.8647 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.18 |
| InChI Key: | WCUITNKOCNSEFY-UHFFFAOYSA-N |