(1-ethyl-1H-pyrazol-5-yl)[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Chemical Structure Depiction of
(1-ethyl-1H-pyrazol-5-yl)[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
(1-ethyl-1H-pyrazol-5-yl)[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Compound characteristics
| Compound ID: | SC09-0347 |
| Compound Name: | (1-ethyl-1H-pyrazol-5-yl)[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone |
| Molecular Weight: | 363.42 |
| Molecular Formula: | C20 H21 N5 O2 |
| Smiles: | CCn1c(ccn1)C(N1Cc2cc(ccc2OC[C@H]1C)c1cncnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.767 |
| logD: | 1.767 |
| logSw: | -2.0177 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.181 |
| InChI Key: | BSSXAJJINGOHAB-CQSZACIVSA-N |