N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-3,3-dimethyl-N-(prop-2-en-1-yl)butanamide
Chemical Structure Depiction of
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-3,3-dimethyl-N-(prop-2-en-1-yl)butanamide
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-3,3-dimethyl-N-(prop-2-en-1-yl)butanamide
Compound characteristics
| Compound ID: | V004-0482 |
| Compound Name: | N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-3,3-dimethyl-N-(prop-2-en-1-yl)butanamide |
| Molecular Weight: | 470.61 |
| Molecular Formula: | C27 H38 N2 O5 |
| Smiles: | Cc1ccc(CN(CCc2ccc(c(c2)OC)OC)C(CN(CC=C)C(CC(C)(C)C)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.1433 |
| logD: | 4.1433 |
| logSw: | -4.3465 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.358 |
| InChI Key: | RJKLPBMKATVGRR-UHFFFAOYSA-N |