N-{rel-(1R,5S)-8-[3-(1H-indol-3-yl)propanoyl]-8-azabicyclo[3.2.1]octan-3-yl}-5-methylpyrazine-2-carboxamide
Chemical Structure Depiction of
N-{rel-(1R,5S)-8-[3-(1H-indol-3-yl)propanoyl]-8-azabicyclo[3.2.1]octan-3-yl}-5-methylpyrazine-2-carboxamide
N-{rel-(1R,5S)-8-[3-(1H-indol-3-yl)propanoyl]-8-azabicyclo[3.2.1]octan-3-yl}-5-methylpyrazine-2-carboxamide
Compound characteristics
| Compound ID: | T651-0137 |
| Compound Name: | N-{rel-(1R,5S)-8-[3-(1H-indol-3-yl)propanoyl]-8-azabicyclo[3.2.1]octan-3-yl}-5-methylpyrazine-2-carboxamide |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C24 H27 N5 O2 |
| Smiles: | Cc1cnc(cn1)C(NC1C[C@@H]2CC[C@H](C1)N2C(CCc1c[nH]c2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6641 |
| logD: | 1.6641 |
| logSw: | -1.9843 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.13 |
| InChI Key: | YYDUPXUMGDKPSE-OALUTQOASA-N |