N-{rel-(1R,5S)-8-[(4-chloro-2-methylphenoxy)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}-5-methylpyrazine-2-carboxamide
Chemical Structure Depiction of
N-{rel-(1R,5S)-8-[(4-chloro-2-methylphenoxy)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}-5-methylpyrazine-2-carboxamide
N-{rel-(1R,5S)-8-[(4-chloro-2-methylphenoxy)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}-5-methylpyrazine-2-carboxamide
Compound characteristics
| Compound ID: | T651-0669 |
| Compound Name: | N-{rel-(1R,5S)-8-[(4-chloro-2-methylphenoxy)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}-5-methylpyrazine-2-carboxamide |
| Molecular Weight: | 428.92 |
| Molecular Formula: | C22 H25 Cl N4 O3 |
| Smiles: | Cc1cc(ccc1OCC(N1[C@H]2CC[C@@H]1CC(C2)NC(c1cnc(C)cn1)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3667 |
| logD: | 2.3667 |
| logSw: | -3.0848 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.845 |
| InChI Key: | HEBRXFZGRWDBBD-AYHJJNSGSA-N |