N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methoxy-2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyridin-4-yl)oxy]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methoxy-2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyridin-4-yl)oxy]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methoxy-2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyridin-4-yl)oxy]acetamide
Compound characteristics
| Compound ID: | G862-0274 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methoxy-2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyridin-4-yl)oxy]acetamide |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C20 H20 N4 O5 S2 |
| Smiles: | Cc1nnc(SCc2cc(c(cn2)OC)OCC(NCc2ccc3c(c2)OCO3)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.0329 |
| logD: | 2.0292 |
| logSw: | -2.5683 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.803 |
| InChI Key: | KBINCNSXKQGKHB-UHFFFAOYSA-N |