{4-[5-(azepan-1-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[5-(azepan-1-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(thiophen-2-yl)methanone
{4-[5-(azepan-1-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | 8014-3378 |
| Compound Name: | {4-[5-(azepan-1-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(thiophen-2-yl)methanone |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C21 H25 F N4 O3 S |
| Smiles: | C1CCCN(CC1)c1cc(c(cc1F)[N+]([O-])=O)N1CCN(CC1)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4329 |
| logD: | 4.4329 |
| logSw: | -4.3728 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.428 |
| InChI Key: | XMQLMUBBBARKAJ-UHFFFAOYSA-N |