N-[4-(butan-2-yl)-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-4-fluorobenzamide
Chemical Structure Depiction of
N-[4-(butan-2-yl)-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-4-fluorobenzamide
N-[4-(butan-2-yl)-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | V013-5337 |
| Compound Name: | N-[4-(butan-2-yl)-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-4-fluorobenzamide |
| Molecular Weight: | 384.45 |
| Molecular Formula: | C22 H25 F N2 O3 |
| Smiles: | CCC(C)N1Cc2cc(ccc2OC(CC)C1=O)NC(c1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4776 |
| logD: | 4.4761 |
| logSw: | -4.2954 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.609 |
| InChI Key: | ONEWXCSTRIPOJL-UHFFFAOYSA-N |