4-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Chemical Structure Depiction of
4-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
4-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | V005-7053 |
| Compound Name: | 4-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine |
| Molecular Weight: | 521.5 |
| Molecular Formula: | C22 H25 Br N4 O2 S2 |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c3CCCCc3sc2n1)N1CCN(CC1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0758 |
| logD: | 5.6462 |
| logSw: | -5.7733 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.73 |
| InChI Key: | TXSDDZASXHWXLK-UHFFFAOYSA-N |