AC1M1BP3
2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide
Also Known As: 2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide|2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide|2-((4-allyl-5-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,4-dimethoxyphenyl)acetamide|N-(2,4-dimethoxyphenyl)-2-[5-(3-chlorophenyl)-4-prop-2-enyl(1,2,4-triazol-3-yl thio)]acetamide
| Molecular Formula | C21H21ClN4O3S |
|---|---|
| Molecular Weight | 444.1023 g/mol |
| LogP | 4.5325 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 444.1023 |
| Monoisotopic Mass | 444.1023 |
| Heavy Atoms | 30 |
| Complexity | 1054.4808 |
Chemical Identifiers
| CAS Number | 849006-63-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC(=CC=C3)Cl)OC |
Product Overview
AC1M1BP3 (CAS 849006-63-9), with molecular formula C21H21ClN4O3S and molecular weight 444.1023 g/mol. IUPAC: 2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide.
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