2-cyclopropyl-N-{[(2RS)-1-ethylpyrrolidin-2-yl]methyl}-3-(3-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclopropyl-N-{[(2RS)-1-ethylpyrrolidin-2-yl]methyl}-3-(3-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclopropyl-N-{[(2RS)-1-ethylpyrrolidin-2-yl]methyl}-3-(3-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | V017-1919 |
| Compound Name: | 2-cyclopropyl-N-{[(2RS)-1-ethylpyrrolidin-2-yl]methyl}-3-(3-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Smiles: | CCN1CCC[C@@H]1CNC(C1C(c2cccc(c2)OC)N(C2CC2)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2911 |
| logD: | 1.9603 |
| logSw: | -3.6702 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.068 |
| InChI Key: | DYUBNJRYOJLSNZ-NWSMCOELSA-N |