8-(hexylsulfanyl)-2,3-dimethyl-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one
Chemical Structure Depiction of
8-(hexylsulfanyl)-2,3-dimethyl-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one
8-(hexylsulfanyl)-2,3-dimethyl-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one
Compound characteristics
| Compound ID: | 4333-3690 |
| Compound Name: | 8-(hexylsulfanyl)-2,3-dimethyl-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one |
| Molecular Weight: | 412.57 |
| Molecular Formula: | C21 H24 N4 O S2 |
| Smiles: | CCCCCCSc1nnc2N(C(c3c(C)c(C)sc3n12)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9114 |
| logD: | 5.9114 |
| logSw: | -5.3915 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.424 |
| InChI Key: | TUGCAWUANPLQRA-UHFFFAOYSA-N |