2-[methyl(phenyl)amino]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-[methyl(phenyl)amino]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
2-[methyl(phenyl)amino]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | C094-0161 |
| Compound Name: | 2-[methyl(phenyl)amino]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 447.49 |
| Molecular Formula: | C25 H25 N3 O5 |
| Smiles: | CC(C)c1ccc(cc1)NC(C(c1cc2c(cc1[N+]([O-])=O)OCO2)N(C)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4192 |
| logD: | 5.4192 |
| logSw: | -5.3545 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.271 |
| InChI Key: | QMSSOAGQHFXFBM-XMMPIXPASA-N |