(11aR)-N-(3-bromophenyl)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Chemical Structure Depiction of
(11aR)-N-(3-bromophenyl)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
(11aR)-N-(3-bromophenyl)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Compound characteristics
| Compound ID: | N107-0208 |
| Compound Name: | (11aR)-N-(3-bromophenyl)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide |
| Molecular Weight: | 392.29 |
| Molecular Formula: | C18 H22 Br N3 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C(Nc1cccc(c1)[Br])=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9008 |
| logD: | 2.9007 |
| logSw: | -3.3836 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.941 |
| InChI Key: | MHZGIUCKCLVZDE-WOSRLPQWSA-N |