[7-(pyrrolidin-1-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](thiophen-3-yl)methanone
Chemical Structure Depiction of
[7-(pyrrolidin-1-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](thiophen-3-yl)methanone
[7-(pyrrolidin-1-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](thiophen-3-yl)methanone
Compound characteristics
| Compound ID: | S555-0224 |
| Compound Name: | [7-(pyrrolidin-1-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](thiophen-3-yl)methanone |
| Molecular Weight: | 328.43 |
| Molecular Formula: | C18 H20 N2 O2 S |
| Smiles: | C1CCN(C1)c1ccc2c(CN(CCO2)C(c2ccsc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1965 |
| logD: | 3.1962 |
| logSw: | -3.2311 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.6677 |
| InChI Key: | QXIZABBPYYDPPH-UHFFFAOYSA-N |