2-benzyl-4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Chemical Structure Depiction of
2-benzyl-4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
2-benzyl-4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | V013-2397 |
| Compound Name: | 2-benzyl-4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine |
| Molecular Weight: | 522.66 |
| Molecular Formula: | C27 H27 F N4 O2 S2 |
| Salt: | not_available |
| Smiles: | C1CCc2c(C1)c1c(nc(Cc3ccccc3)nc1s2)N1CCN(CC1)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3606 |
| logD: | 6.2385 |
| logSw: | -6.2216 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.458 |
| InChI Key: | WKSVUXYXWIWJTP-UHFFFAOYSA-N |