N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-methylphenyl)carbamoyl]-N~2~-[(oxolan-2-yl)methyl]-N-[(thiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-methylphenyl)carbamoyl]-N~2~-[(oxolan-2-yl)methyl]-N-[(thiophen-2-yl)methyl]glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-methylphenyl)carbamoyl]-N~2~-[(oxolan-2-yl)methyl]-N-[(thiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V017-3103 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[(4-methylphenyl)carbamoyl]-N~2~-[(oxolan-2-yl)methyl]-N-[(thiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 521.64 |
| Molecular Formula: | C28 H31 N3 O5 S |
| Smiles: | Cc1ccc(cc1)NC(N(CC1CCCO1)CC(N(Cc1ccc2c(c1)OCO2)Cc1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1241 |
| logD: | 4.1241 |
| logSw: | -4.1307 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.47 |
| InChI Key: | CDNDQKCRURFQDF-HSZRJFAPSA-N |