AC1Q4BBC
N-(4-chloro-2-methylphenyl)-2-[[4-(4-methoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(4-chloro-2-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(4-chloro-2-methylphenyl)-2-((4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(4-chloro-2-methylphenyl)-2-[[4-(4-methoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(4-chloro-2-methylphenyl)-2-[4-(4-methoxyphenyl)-5-(phenoxymethyl)(1,2,4-tri azol-3-ylthio)]acetamide
| Molecular Formula | C25H23ClN4O3S |
|---|---|
| Molecular Weight | 494.11795 g/mol |
| LogP | 5.54752 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 494.11795 |
| Monoisotopic Mass | 494.11795 |
| Heavy Atoms | 34 |
| Complexity | 1263.1582 |
Chemical Identifiers
| CAS Number | 899400-85-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)COC4=CC=CC=C4 |
Product Overview
AC1Q4BBC (CAS 899400-85-2), with molecular formula C25H23ClN4O3S and molecular weight 494.11795 g/mol. IUPAC: N-(4-chloro-2-methylphenyl)-2-[[4-(4-methoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
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