AC1M3W90
3,4-dichloro-N-[2-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide
Also Known As: 3,4-dichloro-N-[2-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide|3,4-dichloro-N-{2-[5-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
CAS: 714282-16-3
| Molecular Formula | C20H18Cl2FN5O2S |
|---|---|
| Molecular Weight | 481.05423 g/mol |
| LogP | 3.9643 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 481.05423 |
| Monoisotopic Mass | 481.05423 |
| Heavy Atoms | 31 |
| Complexity | 1091.6743 |
Chemical Identifiers
| CAS Number | 714282-16-3 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
AC1M3W90 (CAS 714282-16-3), with molecular formula C20H18Cl2FN5O2S and molecular weight 481.05423 g/mol. IUPAC: 3,4-dichloro-N-[2-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide.
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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