3-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanoic acid
3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid
Also Known As: CBKinase1_011866|CBKinase1_024266|3-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanoic acid|SR-01000300903-1|BRD-K83493344-001-01-5|F1743-0014|3-(4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)propanoic acid|3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid|3-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)propanoic acid|3-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio}propanoic acid
| Molecular Formula | C16H14N4O2S |
|---|---|
| Molecular Weight | 326.08374 g/mol |
| LogP | 2.8961 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.08374 |
| Monoisotopic Mass | 326.08374 |
| Heavy Atoms | 23 |
| Complexity | 790.3546 |
Chemical Identifiers
| CAS Number | 690249-41-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)O)C3=CC=NC=C3 |
Product Overview
3-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanoic acid (CAS 690249-41-3), with molecular formula C16H14N4O2S and molecular weight 326.08374 g/mol. IUPAC: 3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid.
3-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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