N-{2-ethyl-4-[(3-methoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-fluorobenzamide
Chemical Structure Depiction of
N-{2-ethyl-4-[(3-methoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-fluorobenzamide
N-{2-ethyl-4-[(3-methoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-fluorobenzamide
Compound characteristics
| Compound ID: | V003-7398 |
| Compound Name: | N-{2-ethyl-4-[(3-methoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-fluorobenzamide |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C26 H25 F N2 O4 |
| Smiles: | CCC1C(N(Cc2cccc(c2)OC)Cc2cc(ccc2O1)NC(c1ccccc1F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5751 |
| logD: | 4.5736 |
| logSw: | -4.4945 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.41 |
| InChI Key: | IIPDPGOLOIQBFF-QHCPKHFHSA-N |