N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N~2~-[(2-methylphenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N~2~-[(2-methylphenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N~2~-[(2-methylphenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V011-1733 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N~2~-[(2-methylphenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 507.65 |
| Molecular Formula: | C28 H33 N3 O4 S |
| Smiles: | CCCCN(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)C(Nc1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5612 |
| logD: | 5.5612 |
| logSw: | -5.2801 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.368 |
| InChI Key: | WPLYXFDPDMAVOP-UHFFFAOYSA-N |