1-{4-[3,5-bis(trifluoromethyl)benzoyl]-3-methylpiperazin-1-yl}-2-[4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Chemical Structure Depiction of
1-{4-[3,5-bis(trifluoromethyl)benzoyl]-3-methylpiperazin-1-yl}-2-[4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
1-{4-[3,5-bis(trifluoromethyl)benzoyl]-3-methylpiperazin-1-yl}-2-[4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | V013-5107 |
| Compound Name: | 1-{4-[3,5-bis(trifluoromethyl)benzoyl]-3-methylpiperazin-1-yl}-2-[4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one |
| Molecular Weight: | 625.63 |
| Molecular Formula: | C30 H29 F6 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)=O)C(CN1CCc2c(ccs2)C1c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8307 |
| logD: | 5.8082 |
| logSw: | -5.6132 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.74 |
| InChI Key: | FTWOBEOGJLXSBT-UHFFFAOYSA-N |