(1-ethyl-1H-pyrazol-4-yl)[(3S)-7-(3-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Chemical Structure Depiction of
(1-ethyl-1H-pyrazol-4-yl)[(3S)-7-(3-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
(1-ethyl-1H-pyrazol-4-yl)[(3S)-7-(3-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Compound characteristics
| Compound ID: | SC09-0087 |
| Compound Name: | (1-ethyl-1H-pyrazol-4-yl)[(3S)-7-(3-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone |
| Molecular Weight: | 379.43 |
| Molecular Formula: | C22 H22 F N3 O2 |
| Smiles: | CCn1cc(cn1)C(N1Cc2cc(ccc2OC[C@@H]1C)c1cccc(c1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 4.2014 |
| logD: | 4.2014 |
| logSw: | -4.1751 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.844 |
| InChI Key: | JPAAKADEGWIVDY-OAHLLOKOSA-N |