5-(2H-1,3-benzodioxol-5-yl)-N-{3-[methyl(phenyl)amino]propyl}-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-N-{3-[methyl(phenyl)amino]propyl}-1,2-oxazole-3-carboxamide
5-(2H-1,3-benzodioxol-5-yl)-N-{3-[methyl(phenyl)amino]propyl}-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | V013-0348 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-N-{3-[methyl(phenyl)amino]propyl}-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 379.41 |
| Molecular Formula: | C21 H21 N3 O4 |
| Salt: | not_available |
| Smiles: | CN(CCCNC(c1cc(c2ccc3c(c2)OCO3)on1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.251 |
| logD: | 3.2461 |
| logSw: | -3.4911 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.349 |
| InChI Key: | PDCYWPTYBHSBIH-UHFFFAOYSA-N |