5-amino-1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C200-1526 |
| Compound Name: | 5-amino-1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 384.35 |
| Molecular Formula: | C17 H16 N6 O5 |
| Smiles: | C(c1ccco1)NC(c1c(N)n(CC(Nc2ccc3c(c2)OCO3)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8638 |
| logD: | 0.8637 |
| logSw: | -2.0445 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 118.623 |
| InChI Key: | FDOHALCBGZNUJW-UHFFFAOYSA-N |