N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylbutanamide
Chemical Structure Depiction of
N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylbutanamide
N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylbutanamide
Compound characteristics
| Compound ID: | V010-7811 |
| Compound Name: | N-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylbutanamide |
| Molecular Weight: | 481.55 |
| Molecular Formula: | C26 H31 N3 O6 |
| Smiles: | CC(C)CC(N(CCc1ccc(c(c1)OC)OC)CCc1nc(c2ccc3c(c2)OCO3)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4378 |
| logD: | 4.4378 |
| logSw: | -4.405 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.598 |
| InChI Key: | CGQJGCPSPRJZPB-UHFFFAOYSA-N |