AC1MFFD2
(Z)-3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: AB00098196-01|(Z)-3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile|3-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]acrylonitrile|(2Z)-3-(4-Chloro-2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile|3-[(4-chloro-2,5-dimethoxy-phenyl)amino]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
| Molecular Formula | C21H18ClN3O3S |
|---|---|
| Molecular Weight | 427.07574 g/mol |
| LogP | 5.46588 |
| Topological Polar Surface Area | 76.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 427.07574 |
| Monoisotopic Mass | 427.07574 |
| Heavy Atoms | 29 |
| Complexity | 1071.7656 |
Chemical Identifiers
| CAS Number | 5813-59-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CSC(=N2)/C(=C\NC3=CC(=C(C=C3OC)Cl)OC)/C#N |
Product Overview
AC1MFFD2 (CAS 5813-59-2), with molecular formula C21H18ClN3O3S and molecular weight 427.07574 g/mol. IUPAC: (Z)-3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
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