1-[4-(2,5-dichlorobenzene-1-sulfonyl)-3-methylpiperazin-1-yl]-3-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
Chemical Structure Depiction of
1-[4-(2,5-dichlorobenzene-1-sulfonyl)-3-methylpiperazin-1-yl]-3-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
1-[4-(2,5-dichlorobenzene-1-sulfonyl)-3-methylpiperazin-1-yl]-3-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
Compound characteristics
| Compound ID: | V025-3259 |
| Compound Name: | 1-[4-(2,5-dichlorobenzene-1-sulfonyl)-3-methylpiperazin-1-yl]-3-[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one |
| Molecular Weight: | 596.57 |
| Molecular Formula: | C27 H28 Cl2 F N3 O3 S2 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1S(c1cc(ccc1[Cl])[Cl])(=O)=O)C(CCN1CCc2c(ccs2)C1c1cccc(c1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1603 |
| logD: | 4.7583 |
| logSw: | -5.6764 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.015 |
| InChI Key: | ZUBFLAGZJNQECR-UHFFFAOYSA-N |