N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-methylphenyl)carbamoyl]-N~2~-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-methylphenyl)carbamoyl]-N~2~-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-methylphenyl)carbamoyl]-N~2~-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V024-5125 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-methylphenyl)carbamoyl]-N~2~-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 507.65 |
| Molecular Formula: | C28 H33 N3 O4 S |
| Smiles: | CC(C)CN(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)C(Nc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7203 |
| logD: | 5.7203 |
| logSw: | -5.3685 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.088 |
| InChI Key: | MTGRGYCGUAEXFV-UHFFFAOYSA-N |