N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)amino]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)amino]pyridine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)amino]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | G416-0047 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)amino]pyridine-3-carboxamide |
| Molecular Weight: | 469.47 |
| Molecular Formula: | C22 H19 N3 O7 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1cc(cnc1)NS(c1ccc2c(c1)OCCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7243 |
| logD: | 1.7202 |
| logSw: | -2.4186 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.847 |
| InChI Key: | CEAVRPLFEMTUMT-UHFFFAOYSA-N |