2-ethyl-1-(4-{3-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propanoyl}-2-methylpiperazin-1-yl)hexan-1-one
Chemical Structure Depiction of
2-ethyl-1-(4-{3-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propanoyl}-2-methylpiperazin-1-yl)hexan-1-one
2-ethyl-1-(4-{3-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propanoyl}-2-methylpiperazin-1-yl)hexan-1-one
Compound characteristics
| Compound ID: | V025-6768 |
| Compound Name: | 2-ethyl-1-(4-{3-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propanoyl}-2-methylpiperazin-1-yl)hexan-1-one |
| Molecular Weight: | 513.72 |
| Molecular Formula: | C29 H40 F N3 O2 S |
| Salt: | not_available |
| Smiles: | CCCCC(CC)C(N1CCN(CC1C)C(CCN1CCc2c(ccs2)C1c1cccc(c1)F)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7009 |
| logD: | 5.2988 |
| logSw: | -5.368 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.446 |
| InChI Key: | KVPAGDBGALSPGE-UHFFFAOYSA-N |