N-(2-{benzyl[(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(2-{benzyl[(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-2H-1,3-benzodioxole-5-carboxamide
N-(2-{benzyl[(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V026-8122 |
| Compound Name: | N-(2-{benzyl[(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 464.52 |
| Molecular Formula: | C26 H28 N2 O6 |
| Smiles: | Cc1ccc(CN(Cc2ccccc2)C(CN(CCOC)C(c2ccc3c(c2)OCO3)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.0183 |
| logD: | 3.0183 |
| logSw: | -3.2074 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.832 |
| InChI Key: | JJKQKIKLIRJMHZ-UHFFFAOYSA-N |