5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{[2-(2,3-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{[2-(2,3-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{[2-(2,3-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L937-0439 |
| Compound Name: | 5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{[2-(2,3-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 492.49 |
| Molecular Formula: | C24 H24 N6 O6 |
| Smiles: | Cc1c(Cn2c(c(C(Nc3ccc4c(c3)OCCO4)=O)nn2)N)nc(c2cccc(c2OC)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 1.3865 |
| logD: | 1.3864 |
| logSw: | -2.4634 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 118.58 |
| InChI Key: | QIIXMLNLHNADIE-UHFFFAOYSA-N |