(3R)-4-[(3-fluoropyridin-4-yl)methyl]-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
(3R)-4-[(3-fluoropyridin-4-yl)methyl]-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
(3R)-4-[(3-fluoropyridin-4-yl)methyl]-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | SC09-0291 |
| Compound Name: | (3R)-4-[(3-fluoropyridin-4-yl)methyl]-3-methyl-7-(pyrimidin-5-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 350.39 |
| Molecular Formula: | C20 H19 F N4 O |
| Smiles: | C[C@@H]1COc2ccc(cc2CN1Cc1ccncc1F)c1cncnc1 |
| Stereo: | ABSOLUTE |
| logP: | 2.5539 |
| logD: | 2.5394 |
| logSw: | -2.4983 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.86 |
| InChI Key: | GIFNIKQGSCEHSS-CQSZACIVSA-N |