[(3S)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](pyrimidin-5-yl)methanone
Chemical Structure Depiction of
[(3S)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](pyrimidin-5-yl)methanone
[(3S)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](pyrimidin-5-yl)methanone
Compound characteristics
| Compound ID: | SC09-0312 |
| Compound Name: | [(3S)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](pyrimidin-5-yl)methanone |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C19 H17 N5 O2 |
| Smiles: | C[C@H]1COc2ccc(cc2CN1C(c1cncnc1)=O)c1cncnc1 |
| Stereo: | ABSOLUTE |
| logP: | 0.9092 |
| logD: | 0.9092 |
| logSw: | -1.4361 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.842 |
| InChI Key: | ZXIFHAGYFFBXCF-ZDUSSCGKSA-N |