ethyl 4-[(2,3-dimethyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(2,3-dimethyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carbonyl)amino]benzoate
ethyl 4-[(2,3-dimethyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | 5900-0018 |
| Compound Name: | ethyl 4-[(2,3-dimethyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carbonyl)amino]benzoate |
| Molecular Weight: | 408.45 |
| Molecular Formula: | C23 H24 N2 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1C2CC(C)(N(C)C1=O)Oc1ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3223 |
| logD: | 3.3198 |
| logSw: | -3.6897 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.606 |
| InChI Key: | JTACJWZZFAPPCS-UHFFFAOYSA-N |