N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-benzyl-5-phenyl-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-benzyl-5-phenyl-1,2-oxazole-3-carboxamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-benzyl-5-phenyl-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | V026-3159 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-benzyl-5-phenyl-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 469.5 |
| Molecular Formula: | C27 H23 N3 O5 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN(Cc1ccccc1)C(c1cc(c2ccccc2)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1814 |
| logD: | 4.1814 |
| logSw: | -4.3633 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.3 |
| InChI Key: | WQJFXZTVCNECFJ-UHFFFAOYSA-N |