4-methyl-1-[rel-(5aR,9aS)-7-methyloctahydropyrido[4,3-e][1,4]oxazepin-1(5H)-yl]pentan-1-one
Chemical Structure Depiction of
4-methyl-1-[rel-(5aR,9aS)-7-methyloctahydropyrido[4,3-e][1,4]oxazepin-1(5H)-yl]pentan-1-one
4-methyl-1-[rel-(5aR,9aS)-7-methyloctahydropyrido[4,3-e][1,4]oxazepin-1(5H)-yl]pentan-1-one
Compound characteristics
| Compound ID: | SB16-1034 |
| Compound Name: | 4-methyl-1-[rel-(5aR,9aS)-7-methyloctahydropyrido[4,3-e][1,4]oxazepin-1(5H)-yl]pentan-1-one |
| Molecular Weight: | 268.4 |
| Molecular Formula: | C15 H28 N2 O2 |
| Smiles: | CC(C)CCC(N1CCOC[C@H]2CN(C)CC[C@@H]12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4258 |
| logD: | -0.4532 |
| logSw: | -1.2625 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.9885 |
| InChI Key: | BGXCOUBHFSHVFG-KBPBESRZSA-N |