2-((4-Allyl-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetic acid
2-[[5-(3,4-dimethoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
Also Known As: Oprea1_017639|AJ-292/37212009|2-((4-Allyl-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetic acid|SR-01000005475-1|{[4-allyl-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid|2-[[5-(3,4-dimethoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetic Acid|2-{[5-(3,4-dimethoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid|[4-allyl-5-(3,4-dimethoxy-phenyl)-4 h-[1,2,4]triazol-3-ylsulfanyl]-acetic acid|[4-Allyl-5-(3,4-dimethoxy-phenyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-acetic acid|{[5-(3,4-dimethoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid|2-((4-Allyl-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)aceticacid|2-[5-(3,4-dimethoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-ylthio]acetic acid
| Molecular Formula | C15H17N3O4S |
|---|---|
| Molecular Weight | 335.09396 g/mol |
| LogP | 2.325 |
| Topological Polar Surface Area | 86.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 335.09396 |
| Monoisotopic Mass | 335.09396 |
| Heavy Atoms | 23 |
| Complexity | 714.74274 |
Chemical Identifiers
| CAS Number | 313251-07-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)O)OC |
Product Overview
2-((4-Allyl-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetic acid (CAS 313251-07-9), with molecular formula C15H17N3O4S and molecular weight 335.09396 g/mol. IUPAC: 2-[[5-(3,4-dimethoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid.
2-((4-Allyl-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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