N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[1-(morpholin-4-yl)-1-(thiophen-2-yl)propan-2-yl]ethanediamide
Chemical Structure Depiction of
N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[1-(morpholin-4-yl)-1-(thiophen-2-yl)propan-2-yl]ethanediamide
N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[1-(morpholin-4-yl)-1-(thiophen-2-yl)propan-2-yl]ethanediamide
Compound characteristics
| Compound ID: | C609-0014 |
| Compound Name: | N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[1-(morpholin-4-yl)-1-(thiophen-2-yl)propan-2-yl]ethanediamide |
| Molecular Weight: | 431.51 |
| Molecular Formula: | C21 H25 N3 O5 S |
| Smiles: | CC(C(c1cccs1)N1CCOCC1)NC(C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7034 |
| logD: | 1.6967 |
| logSw: | -2.503 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.567 |
| InChI Key: | IIFZOFCONCABJW-UHFFFAOYSA-N |