2-{[2-(2-methylpropanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(prop-2-en-1-yl)butanamide
Chemical Structure Depiction of
2-{[2-(2-methylpropanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(prop-2-en-1-yl)butanamide
2-{[2-(2-methylpropanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(prop-2-en-1-yl)butanamide
Compound characteristics
| Compound ID: | V024-3516 |
| Compound Name: | 2-{[2-(2-methylpropanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(prop-2-en-1-yl)butanamide |
| Molecular Weight: | 420.55 |
| Molecular Formula: | C26 H32 N2 O3 |
| Smiles: | CCC(C(NCC=C)=O)Oc1ccc2CCN(C(c3ccccc3)c2c1)C(C(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8403 |
| logD: | 4.8403 |
| logSw: | -4.523 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.331 |
| InChI Key: | DDSNDBCTWOXONE-UHFFFAOYSA-N |