N-{4-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-{4-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-3,3-dimethylbutanamide
N-{4-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V023-5775 |
| Compound Name: | N-{4-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-3,3-dimethylbutanamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C25 H32 N2 O4 |
| Smiles: | CC1C(N(CCc2ccccc2OC)Cc2cc(ccc2O1)NC(CC(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4316 |
| logD: | 4.4315 |
| logSw: | -4.3936 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.339 |
| InChI Key: | LDGFIAQTLKRZNB-KRWDZBQOSA-N |