4-[2-(4-fluorophenyl)-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide
Chemical Structure Depiction of
4-[2-(4-fluorophenyl)-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide
4-[2-(4-fluorophenyl)-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide
Compound characteristics
Compound ID: | L123-0670 |
Compound Name: | 4-[2-(4-fluorophenyl)-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]-N-[2-(thiophen-2-yl)ethyl]benzamide |
Molecular Weight: | 458.6 |
Molecular Formula: | C28 H27 F N2 O S |
Smiles: | C1CCc2cc(c3ccc(cc3)F)n(c3ccc(cc3)C(NCCc3cccs3)=O)c2CC1 |
Stereo: | ACHIRAL |
logP: | 6.497 |
logD: | 6.497 |
logSw: | -5.9781 |
Hydrogen bond acceptors count: | 2 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 27.1707 |
InChI Key: | CIFQMMKMLVATLU-UHFFFAOYSA-N |