(5Z)-8-bromo-5-(1-hydroxyethylidene)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
Chemical Structure Depiction of
(5Z)-8-bromo-5-(1-hydroxyethylidene)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
(5Z)-8-bromo-5-(1-hydroxyethylidene)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one
Compound characteristics
| Compound ID: | 1711-1395 |
| Compound Name: | (5Z)-8-bromo-5-(1-hydroxyethylidene)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3-benzoxazocin-4-one |
| Molecular Weight: | 324.17 |
| Molecular Formula: | C14 H14 Br N O3 |
| Smiles: | C/C(=C1\C2CC(C)(NC1=O)Oc1ccc(cc12)[Br])O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3509 |
| logD: | 2.35 |
| logSw: | -3.0858 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.402 |
| InChI Key: | HEDNMRWRHARRFX-UHFFFAOYSA-N |