(2R*)-8-tert-butyl-3-(3,4-dimethylphenyl)-10-hydroxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Chemical Structure Depiction of
(2R*)-8-tert-butyl-3-(3,4-dimethylphenyl)-10-hydroxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
(2R*)-8-tert-butyl-3-(3,4-dimethylphenyl)-10-hydroxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Compound characteristics
| Compound ID: | C269-0438 |
| Compound Name: | (2R*)-8-tert-butyl-3-(3,4-dimethylphenyl)-10-hydroxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one |
| Molecular Weight: | 380.49 |
| Molecular Formula: | C23 H28 N2 O3 |
| Smiles: | Cc1ccc(cc1C)N1C(N[C@@H]2C[C@]1(C)Oc1c2cc(cc1O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 6.0503 |
| logD: | 6.05 |
| logSw: | -5.2902 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.309 |
| InChI Key: | VVONTHCTQRYRPI-MBSDFSHPSA-N |