N-[(3S,7S,8aS)-2-[(1H-indol-4-yl)methyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-2-[(1H-indol-4-yl)methyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(3S,7S,8aS)-2-[(1H-indol-4-yl)methyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-1477 |
| Compound Name: | N-[(3S,7S,8aS)-2-[(1H-indol-4-yl)methyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C22 H30 N4 O2 |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1Cc1cccc2c1cc[nH]2)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1937 |
| logD: | 2.1508 |
| logSw: | -2.6196 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.149 |
| InChI Key: | ZVWUJHKQVJBBKU-LQWHRVPQSA-N |