AC1LUU5C
propan-2-yl 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]sulfanyl]acetate
Also Known As: AM-807/13103085|propan-2-yl 2-[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanylacetate|isopropyl 2-{[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]sulfanyl}acetate|isopropyl 2-((6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl)thio)acetate|propan-2-yl {[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl}acetate
| Molecular Formula | C21H22N4O5S |
|---|---|
| Molecular Weight | 442.1311 g/mol |
| LogP | 3.14366 |
| Topological Polar Surface Area | 140.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 442.1311 |
| Monoisotopic Mass | 442.1311 |
| Heavy Atoms | 31 |
| Complexity | 1047.9008 |
Chemical Identifiers
| CAS Number | 354554-50-0 |
|---|---|
| SMILES | CC(C)OC(=O)CSC1=C(C(=C(C(=N1)N)C#N)C2=CC(=C(C(=C2)OC)OC)OC)C#N |
Product Overview
AC1LUU5C (CAS 354554-50-0), with molecular formula C21H22N4O5S and molecular weight 442.1311 g/mol. IUPAC: propan-2-yl 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]sulfanyl]acetate.
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