AC1M02E3
2-O-tert-butyl 4-O-ethyl 5-[[(Z)-2-cyano-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: (Z)-2-tert-butyl 4-ethyl 5-((2-cyano-2-(4-(3,4-dimethylphenyl)thiazol-2-yl)vinyl)amino)-3-methylthiophene-2,4-dicarboxylate|2-O-tert-butyl 4-O-ethyl 5-[[(Z)-2-cyano-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methylthiophene-2,4-dicarboxylate|2-tert-butyl 4-ethyl 5-({(Z)-2-cyano-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
| Molecular Formula | C27H29N3O4S2 |
|---|---|
| Molecular Weight | 523.16 g/mol |
| LogP | 6.90544 |
| Topological Polar Surface Area | 101.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 523.16 |
| Monoisotopic Mass | 523.16 |
| Heavy Atoms | 36 |
| Complexity | 1370.5314 |
Chemical Identifiers
| CAS Number | 577700-00-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)N/C=C(/C#N)\C2=NC(=CS2)C3=CC(=C(C=C3)C)C |
Product Overview
AC1M02E3 (CAS 577700-00-6), with molecular formula C27H29N3O4S2 and molecular weight 523.16 g/mol. IUPAC: 2-O-tert-butyl 4-O-ethyl 5-[[(Z)-2-cyano-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methylthiophene-2,4-dicarboxylate.