4-[4-(benzenesulfonyl)piperazin-1-yl]-2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
Chemical Structure Depiction of
4-[4-(benzenesulfonyl)piperazin-1-yl]-2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
4-[4-(benzenesulfonyl)piperazin-1-yl]-2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | V030-3500 |
| Compound Name: | 4-[4-(benzenesulfonyl)piperazin-1-yl]-2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine |
| Molecular Weight: | 533.71 |
| Molecular Formula: | C28 H31 N5 O2 S2 |
| Salt: | not_available |
| Smiles: | CCN1CCc2c3c(nc(Cc4ccccc4)nc3sc2C1)N1CCN(CC1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3789 |
| logD: | 5.3015 |
| logSw: | -5.5802 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.928 |
| InChI Key: | KGONQNUEKSUUDK-UHFFFAOYSA-N |