(5-methylthiophen-2-yl)[7-(pyrrolidin-1-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Chemical Structure Depiction of
(5-methylthiophen-2-yl)[7-(pyrrolidin-1-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
(5-methylthiophen-2-yl)[7-(pyrrolidin-1-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Compound characteristics
| Compound ID: | S555-0203 |
| Compound Name: | (5-methylthiophen-2-yl)[7-(pyrrolidin-1-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone |
| Molecular Weight: | 342.46 |
| Molecular Formula: | C19 H22 N2 O2 S |
| Smiles: | Cc1ccc(C(N2CCOc3ccc(cc3C2)N2CCCC2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.1542 |
| logD: | 4.154 |
| logSw: | -4.1804 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.6677 |
| InChI Key: | HCFOJAXZDSAMFA-UHFFFAOYSA-N |