(3S)-4-[(6-methoxypyridin-2-yl)methyl]-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
(3S)-4-[(6-methoxypyridin-2-yl)methyl]-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
(3S)-4-[(6-methoxypyridin-2-yl)methyl]-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | SC09-0296 |
| Compound Name: | (3S)-4-[(6-methoxypyridin-2-yl)methyl]-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C21 H22 N4 O2 |
| Smiles: | C[C@H]1COc2ccc(cc2CN1Cc1cccc(n1)OC)c1cncnc1 |
| Stereo: | ABSOLUTE |
| logP: | 3.0183 |
| logD: | 2.2317 |
| logSw: | -3.0254 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.897 |
| InChI Key: | BJYBNKLBFPDYNT-HNNXBMFYSA-N |