N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-benzyl-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-benzyl-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-benzyl-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | V004-2666 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-benzyl-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C29 H27 N3 O5 |
| Smiles: | Cc1ccc(C)c(c1)c1cc(C(N(CC(NCc2ccc3c(c2)OCO3)=O)Cc2ccccc2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.011 |
| logD: | 5.011 |
| logSw: | -4.5926 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.3 |
| InChI Key: | XMIBNYXWPFGLDV-UHFFFAOYSA-N |