N-(3-chloro-4-methylphenyl)-2-({4-[(furan-2-yl)methyl]-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-({4-[(furan-2-yl)methyl]-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
N-(3-chloro-4-methylphenyl)-2-({4-[(furan-2-yl)methyl]-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | F798-0668 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-({4-[(furan-2-yl)methyl]-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide |
| Molecular Weight: | 485.97 |
| Molecular Formula: | C21 H16 Cl N5 O3 S2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1nnc2N(Cc3ccco3)C(c3c(ccs3)n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7512 |
| logD: | 4.751 |
| logSw: | -4.8084 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.229 |
| InChI Key: | VNRUTNLRMDYLMM-UHFFFAOYSA-N |