3-[1-(4-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
3-[1-(4-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-[1-(4-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | Y042-9755 |
| Compound Name: | 3-[1-(4-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 411.89 |
| Molecular Formula: | C22 H22 Cl N3 O3 |
| Smiles: | C1C(CN(C1=O)c1ccc(cc1)[Cl])C(N1C[C@@H]2C[C@H](C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6153 |
| logD: | 2.6153 |
| logSw: | -3.0604 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.335 |
| InChI Key: | REXKTIJMPTYVAG-KSCSMHSMSA-N |