(3,4-dimethylphenyl)[(3S)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Chemical Structure Depiction of
(3,4-dimethylphenyl)[(3S)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
(3,4-dimethylphenyl)[(3S)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Compound characteristics
| Compound ID: | SC09-0242 |
| Compound Name: | (3,4-dimethylphenyl)[(3S)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone |
| Molecular Weight: | 373.45 |
| Molecular Formula: | C23 H23 N3 O2 |
| Smiles: | Cc1ccc(cc1C)C(N1Cc2cc(ccc2OC[C@@H]1C)c1cncnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.9358 |
| logD: | 3.9358 |
| logSw: | -3.788 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.092 |
| InChI Key: | SFFFADYGKQNMLK-KRWDZBQOSA-N |