1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazin-1-yl)heptan-1-one
Chemical Structure Depiction of
1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazin-1-yl)heptan-1-one
1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazin-1-yl)heptan-1-one
Compound characteristics
| Compound ID: | V017-1924 |
| Compound Name: | 1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazin-1-yl)heptan-1-one |
| Molecular Weight: | 485.66 |
| Molecular Formula: | C27 H36 F N3 O2 S |
| Salt: | not_available |
| Smiles: | CCCCCCC(N1CCN(CC1C)C(CN1CCc2c(ccs2)C1c1cccc(c1)F)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2369 |
| logD: | 5.2144 |
| logSw: | -4.9249 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.941 |
| InChI Key: | VCAISCNPOVXLDN-UHFFFAOYSA-N |