5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1,2-oxazole-4-carboxamide
5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | H024-0019 |
| Compound Name: | 5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 409.4 |
| Molecular Formula: | C21 H19 N3 O6 |
| Smiles: | Cc1c(C(Nc2ccc3c(c2)OCCO3)=O)c(NCc2ccc3c(c2)OCO3)on1 |
| Stereo: | ACHIRAL |
| logP: | 1.9735 |
| logD: | 1.9728 |
| logSw: | -2.6835 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.167 |
| InChI Key: | IIPCAVXXYUJRCH-UHFFFAOYSA-N |