1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazin-1-yl)-2-phenoxyethan-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)-2-phenoxyethan-1-one
1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazin-1-yl)-2-phenoxyethan-1-one
Compound characteristics
| Compound ID: | V002-9040 |
| Compound Name: | 1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazin-1-yl)-2-phenoxyethan-1-one |
| Molecular Weight: | 507.63 |
| Molecular Formula: | C28 H30 F N3 O3 S |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(COc1ccccc1)=O)C(CN1CCc2c(ccs2)C1c1cccc(c1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0124 |
| logD: | 3.9899 |
| logSw: | -4.1049 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.168 |
| InChI Key: | HHCPONBBVRXODZ-UHFFFAOYSA-N |