(11aR)-3-[4-(6-methoxy-1H-indole-2-carbonyl)piperazine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-[4-(6-methoxy-1H-indole-2-carbonyl)piperazine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-[4-(6-methoxy-1H-indole-2-carbonyl)piperazine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N119-0076 |
| Compound Name: | (11aR)-3-[4-(6-methoxy-1H-indole-2-carbonyl)piperazine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C26 H33 N5 O4 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C(N1CCN(CC1)C(c1cc2ccc(cc2[nH]1)OC)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.5336 |
| logD: | 2.5336 |
| logSw: | -3.0433 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.275 |
| InChI Key: | JVKQEOKUAYLPAW-GEQKSPFYSA-N |