2-(6-nitro-2H-1,3-benzodioxol-5-yl)-2-[phenyl(prop-2-en-1-yl)amino]-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-(6-nitro-2H-1,3-benzodioxol-5-yl)-2-[phenyl(prop-2-en-1-yl)amino]-N-[4-(propan-2-yl)phenyl]acetamide
2-(6-nitro-2H-1,3-benzodioxol-5-yl)-2-[phenyl(prop-2-en-1-yl)amino]-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | C094-0166 |
| Compound Name: | 2-(6-nitro-2H-1,3-benzodioxol-5-yl)-2-[phenyl(prop-2-en-1-yl)amino]-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C27 H27 N3 O5 |
| Smiles: | CC(C)c1ccc(cc1)NC(C(c1cc2c(cc1[N+]([O-])=O)OCO2)N(CC=C)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1922 |
| logD: | 6.1922 |
| logSw: | -5.4804 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.504 |
| InChI Key: | ZBIGIRRFCWCHTH-AREMUKBSSA-N |