2-[(4-amino-5-benzyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
2-[(4-amino-5-benzyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid
Also Known As: Oprea1_188725|Oprea1_423831|2-[(4-amino-5-benzyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid|2-[(4-amino-5-benzyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid|AG-690/13704107|2-[4-amino-5-benzyl-1,2,4-triazol-3-ylthio]acetic acid|(4-Amino-5-benzyl-4H-[1,2,4]triazol-3-ylsulfanyl)acetic acid|[(4-amino-5-benzyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid|2-[(4-amino-5-benzyl-4H-1,2,4-triazol-3-yl)sulfanyl]aceticacid|[(4-AMINO-5-BENZYL-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETIC ACID
| Molecular Formula | C11H12N4O2S |
|---|---|
| Molecular Weight | 264.06808 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.06808 |
| Monoisotopic Mass | 264.06808 |
| Heavy Atoms | 18 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 337487-57-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NN=C(N2N)SCC(=O)O |
| InChIKey | YQXYEHNOSLJKMM-UHFFFAOYSA-N |
Product Overview
2-[(4-amino-5-benzyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid (CAS 337487-57-7), with molecular formula C11H12N4O2S and molecular weight 264.06808 g/mol. IUPAC: 2-[(4-amino-5-benzyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid.
2-[(4-amino-5-benzyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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