N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl)-L-methionine
Chemical Structure Depiction of
N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl)-L-methionine
N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl)-L-methionine
Compound characteristics
| Compound ID: | Y042-7848 |
| Compound Name: | N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl)-L-methionine |
| Molecular Weight: | 365.45 |
| Molecular Formula: | C17 H23 N3 O4 S |
| Smiles: | CSCC[C@@H](C(O)=O)NC(N1C[C@H]2C[C@@H](C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.9606 |
| logD: | -2.3103 |
| logSw: | -1.595 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.039 |
| InChI Key: | OQKPFTGTVANENL-AVGNSLFASA-N |