3-(2H-1,3-benzodioxol-5-yl)-1-oxo-N-(3-phenylpropyl)-2-propyl-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-1-oxo-N-(3-phenylpropyl)-2-propyl-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
3-(2H-1,3-benzodioxol-5-yl)-1-oxo-N-(3-phenylpropyl)-2-propyl-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | V008-5850 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-1-oxo-N-(3-phenylpropyl)-2-propyl-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C29 H30 N2 O4 |
| Smiles: | CCCN1C(C(C(NCCCc2ccccc2)=O)c2ccccc2C1=O)c1ccc2c(c1)OCO2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2783 |
| logD: | 5.2783 |
| logSw: | -5.2023 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.271 |
| InChI Key: | QVYAGKAFYCTPBK-UHFFFAOYSA-N |