1-[4-(4-butoxybenzoyl)-3-methylpiperazin-1-yl]-2-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-butoxybenzoyl)-3-methylpiperazin-1-yl]-2-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
1-[4-(4-butoxybenzoyl)-3-methylpiperazin-1-yl]-2-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | V002-9075 |
| Compound Name: | 1-[4-(4-butoxybenzoyl)-3-methylpiperazin-1-yl]-2-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one |
| Molecular Weight: | 549.71 |
| Molecular Formula: | C31 H36 F N3 O3 S |
| Salt: | not_available |
| Smiles: | CCCCOc1ccc(cc1)C(N1CCN(CC1C)C(CN1CCc2c(ccs2)C1c1cccc(c1)F)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6583 |
| logD: | 5.6358 |
| logSw: | -5.3697 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.614 |
| InChI Key: | GYEGSRNZEWCNHX-UHFFFAOYSA-N |