4-(4-[(furan-2-yl)methyl]-5-{[(pentamethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
Chemical Structure Depiction of
4-(4-[(furan-2-yl)methyl]-5-{[(pentamethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
4-(4-[(furan-2-yl)methyl]-5-{[(pentamethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
Compound characteristics
| Compound ID: | V008-6206 |
| Compound Name: | 4-(4-[(furan-2-yl)methyl]-5-{[(pentamethylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-phenylquinoline |
| Molecular Weight: | 544.72 |
| Molecular Formula: | C34 H32 N4 O S |
| Salt: | not_available |
| Smiles: | Cc1c(C)c(C)c(CSc2nnc(c3cc(c4ccccc4)nc4ccccc34)n2Cc2ccco2)c(C)c1C |
| Stereo: | ACHIRAL |
| logP: | 9.7597 |
| logD: | 9.7587 |
| logSw: | -6.0734 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.777 |
| InChI Key: | MCTLRFLOMHCGCM-UHFFFAOYSA-N |