[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone
Chemical Structure Depiction of
[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone
[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone
Compound characteristics
| Compound ID: | SC09-0316 |
| Compound Name: | [(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C20 H20 N4 O2 |
| Smiles: | C[C@@H]1COc2ccc(cc2CN1C(c1cccn1C)=O)c1cncnc1 |
| Stereo: | ABSOLUTE |
| logP: | 2.8864 |
| logD: | 2.8864 |
| logSw: | -3.0552 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.509 |
| InChI Key: | XTIQYDGQGNUZKT-CQSZACIVSA-N |