(5-bromopyridin-3-yl){7-[(diethylamino)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
Chemical Structure Depiction of
(5-bromopyridin-3-yl){7-[(diethylamino)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
(5-bromopyridin-3-yl){7-[(diethylamino)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
Compound characteristics
Compound ID: | T634-0395 |
Compound Name: | (5-bromopyridin-3-yl){7-[(diethylamino)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone |
Molecular Weight: | 418.33 |
Molecular Formula: | C20 H24 Br N3 O2 |
Smiles: | CCN(CC)Cc1ccc2c(CN(CCO2)C(c2cc(cnc2)[Br])=O)c1 |
Stereo: | ACHIRAL |
logP: | 3.1475 |
logD: | 1.3939 |
logSw: | -2.833 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 37.871 |
InChI Key: | IZFBNUGJXBHQJN-UHFFFAOYSA-N |