2-[benzyl(2-hydroxyethyl)amino]-N-cyclopentyl-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Chemical Structure Depiction of
2-[benzyl(2-hydroxyethyl)amino]-N-cyclopentyl-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
2-[benzyl(2-hydroxyethyl)amino]-N-cyclopentyl-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Compound characteristics
| Compound ID: | C094-2422 |
| Compound Name: | 2-[benzyl(2-hydroxyethyl)amino]-N-cyclopentyl-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide |
| Molecular Weight: | 441.48 |
| Molecular Formula: | C23 H27 N3 O6 |
| Smiles: | C1CCC(C1)NC(C(c1cc2c(cc1[N+]([O-])=O)OCO2)N(CCO)Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1719 |
| logD: | 3.1233 |
| logSw: | -3.434 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.161 |
| InChI Key: | SHXBQNDYFIELOW-JOCHJYFZSA-N |