N-(2H-1,3-benzodioxol-5-yl)-2-(3-{[(4H-1,2,4-triazol-4-yl)imino]methyl}-1H-indol-1-yl)acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-(3-{[(4H-1,2,4-triazol-4-yl)imino]methyl}-1H-indol-1-yl)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-(3-{[(4H-1,2,4-triazol-4-yl)imino]methyl}-1H-indol-1-yl)acetamide
Compound characteristics
| Compound ID: | 6372-4046 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-(3-{[(4H-1,2,4-triazol-4-yl)imino]methyl}-1H-indol-1-yl)acetamide |
| Molecular Weight: | 388.38 |
| Molecular Formula: | C20 H16 N6 O3 |
| Smiles: | C(C(Nc1ccc2c(c1)OCO2)=O)n1cc(/C=N/n2cnnc2)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 1.9831 |
| logD: | 1.981 |
| logSw: | -2.8702 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.203 |
| InChI Key: | WAFZUFYLKGFMDT-UHFFFAOYSA-N |