(2-methylpyridin-4-yl)[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Chemical Structure Depiction of
(2-methylpyridin-4-yl)[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
(2-methylpyridin-4-yl)[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Compound characteristics
| Compound ID: | SC09-0310 |
| Compound Name: | (2-methylpyridin-4-yl)[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone |
| Molecular Weight: | 360.41 |
| Molecular Formula: | C21 H20 N4 O2 |
| Smiles: | Cc1cc(ccn1)C(N1Cc2cc(ccc2OC[C@H]1C)c1cncnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1798 |
| logD: | 2.1683 |
| logSw: | -2.3948 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.947 |
| InChI Key: | XUJWKLNWAMIJFY-OAHLLOKOSA-N |