N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(tert-butylcarbamoyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(propan-2-yl)glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(tert-butylcarbamoyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(propan-2-yl)glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(tert-butylcarbamoyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(propan-2-yl)glycinamide
Compound characteristics
| Compound ID: | V026-6255 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(tert-butylcarbamoyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(propan-2-yl)glycinamide |
| Molecular Weight: | 459.61 |
| Molecular Formula: | C24 H33 N3 O4 S |
| Smiles: | CC(C)N(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)C(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.513 |
| logD: | 4.513 |
| logSw: | -4.3152 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.249 |
| InChI Key: | UPTPCKRROHASTJ-UHFFFAOYSA-N |