(2RS)-2-methyl-5-(piperidine-1-carbonyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
Chemical Structure Depiction of
(2RS)-2-methyl-5-(piperidine-1-carbonyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
(2RS)-2-methyl-5-(piperidine-1-carbonyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
Compound characteristics
Compound ID: | D018-0087 |
Compound Name: | (2RS)-2-methyl-5-(piperidine-1-carbonyl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one |
Molecular Weight: | 314.38 |
Molecular Formula: | C18 H22 N2 O3 |
Smiles: | C[C@@]12C[C@@H](C(C(N1)=O)C(N1CCCCC1)=O)c1ccccc1O2 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 1.9717 |
logD: | 1.9716 |
logSw: | -2.7657 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.174 |
InChI Key: | LXRVJTYVYXVCNN-UHFFFAOYSA-N |