(5-bromopyridin-3-yl){7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
Chemical Structure Depiction of
(5-bromopyridin-3-yl){7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
(5-bromopyridin-3-yl){7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
Compound characteristics
| Compound ID: | T634-0704 |
| Compound Name: | (5-bromopyridin-3-yl){7-[(piperidin-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone |
| Molecular Weight: | 430.34 |
| Molecular Formula: | C21 H24 Br N3 O2 |
| Smiles: | C1CCN(CC1)Cc1ccc2c(CN(CCO2)C(c2cc(cnc2)[Br])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2605 |
| logD: | 1.6294 |
| logSw: | -2.9568 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.171 |
| InChI Key: | RVDBGZNEKBIVIT-UHFFFAOYSA-N |