2-butyl-4-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Chemical Structure Depiction of
2-butyl-4-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
2-butyl-4-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | V002-4682 |
| Compound Name: | 2-butyl-4-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine |
| Molecular Weight: | 538.65 |
| Molecular Formula: | C25 H29 F3 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | CCCCc1nc(c2c3CCCCc3sc2n1)N1CCN(CC1)S(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0522 |
| logD: | 6.4405 |
| logSw: | -6.1528 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.73 |
| InChI Key: | JJADAESKAFCFIH-UHFFFAOYSA-N |