AC1LHOO1
methyl 2-[[4-methyl-5-[[(3-methylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: F0601-0096|SR-01000094203-1|methyl 2-((4-methyl-5-((3-methylbenzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetate|methyl 2-[[4-methyl-5-[[(3-methylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate|methyl 2-[(4-methyl-5-{[(3-methylphenyl)formamido]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetate|methyl {4-methyl-5-[(m-toluoylamino)methyl]-4H-1,2,4-triazol-3-ylthio}acetate
CAS: 689751-16-4
| Molecular Formula | C15H18N4O3S |
|---|---|
| Molecular Weight | 334.10995 g/mol |
| LogP | 1.31862 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.10995 |
| Monoisotopic Mass | 334.10995 |
| Heavy Atoms | 23 |
| Complexity | 714.4976 |
Chemical Identifiers
| CAS Number | 689751-16-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NCC2=NN=C(N2C)SCC(=O)OC |
Product Overview
AC1LHOO1 (CAS 689751-16-4), with molecular formula C15H18N4O3S and molecular weight 334.10995 g/mol. IUPAC: methyl 2-[[4-methyl-5-[[(3-methylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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