4-methyl-5-[4-(2,4,6-trimethylphenyl)-5-{[(2,4,6-trimethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]-4H-thieno[3,2-b]pyrrole
Chemical Structure Depiction of
4-methyl-5-[4-(2,4,6-trimethylphenyl)-5-{[(2,4,6-trimethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]-4H-thieno[3,2-b]pyrrole
4-methyl-5-[4-(2,4,6-trimethylphenyl)-5-{[(2,4,6-trimethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]-4H-thieno[3,2-b]pyrrole
Compound characteristics
| Compound ID: | E634-0248 |
| Compound Name: | 4-methyl-5-[4-(2,4,6-trimethylphenyl)-5-{[(2,4,6-trimethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]-4H-thieno[3,2-b]pyrrole |
| Molecular Weight: | 486.7 |
| Molecular Formula: | C28 H30 N4 S2 |
| Smiles: | Cc1cc(C)c(CSc2nnc(c3cc4c(ccs4)n3C)n2c2c(C)cc(C)cc2C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.6781 |
| logD: | 8.6779 |
| logSw: | -5.7989 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.6646 |
| InChI Key: | QRLOXCUHXLVPAC-UHFFFAOYSA-N |