N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-cyanophenyl)carbamoyl]-N-[(5-methylfuran-2-yl)methyl]-N~2~-(2-methylpropyl)glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-cyanophenyl)carbamoyl]-N-[(5-methylfuran-2-yl)methyl]-N~2~-(2-methylpropyl)glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-cyanophenyl)carbamoyl]-N-[(5-methylfuran-2-yl)methyl]-N~2~-(2-methylpropyl)glycinamide
Compound characteristics
| Compound ID: | V004-0641 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-cyanophenyl)carbamoyl]-N-[(5-methylfuran-2-yl)methyl]-N~2~-(2-methylpropyl)glycinamide |
| Molecular Weight: | 502.57 |
| Molecular Formula: | C28 H30 N4 O5 |
| Smiles: | CC(C)CN(CC(N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1)=O)C(Nc1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4237 |
| logD: | 4.4237 |
| logSw: | -4.3053 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.388 |
| InChI Key: | GLBOXESBEANWKZ-UHFFFAOYSA-N |