2-benzyl-7-ethyl-4-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
Chemical Structure Depiction of
2-benzyl-7-ethyl-4-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
2-benzyl-7-ethyl-4-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | V008-2940 |
| Compound Name: | 2-benzyl-7-ethyl-4-{4-[3-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine |
| Molecular Weight: | 601.71 |
| Molecular Formula: | C29 H30 F3 N5 O2 S2 |
| Salt: | not_available |
| Smiles: | CCN1CCc2c3c(nc(Cc4ccccc4)nc3sc2C1)N1CCN(CC1)S(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3871 |
| logD: | 6.3097 |
| logSw: | -6.1425 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.928 |
| InChI Key: | VXRHKTSRQXSCFJ-UHFFFAOYSA-N |