2-[(5-anilino-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)acetamide
Chemical Structure Depiction of
2-[(5-anilino-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)acetamide
2-[(5-anilino-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)acetamide
Compound characteristics
Compound ID: | 8016-2788 |
Compound Name: | 2-[(5-anilino-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)acetamide |
Molecular Weight: | 457.51 |
Molecular Formula: | C24 H19 N5 O3 S |
Smiles: | C1c2cc(ccc2C(=O)O1)NC(CSc1nnc(Nc2ccccc2)n1c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.6309 |
logD: | 3.6308 |
logSw: | -3.9705 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.526 |
InChI Key: | ZAGMXSVGWROHRS-UHFFFAOYSA-N |