N~2~-acetyl-N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N~2~-acetyl-N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N-[(3-methylthiophen-2-yl)methyl]glycinamide
N~2~-acetyl-N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V029-6962 |
| Compound Name: | N~2~-acetyl-N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N-[(3-methylthiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 416.54 |
| Molecular Formula: | C22 H28 N2 O4 S |
| Smiles: | CCCCN(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7328 |
| logD: | 3.7328 |
| logSw: | -3.6968 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.985 |
| InChI Key: | YQLZTWPMMYDXRK-UHFFFAOYSA-N |