AC1OIWNU
ethyl 4-[[2-(9-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetyl]amino]benzoate
Also Known As: F2543-0700|ethyl 4-[[2-(9-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetyl]amino]benzoate|ethyl 4-[2-({9-methyl-4-oxo-4H-pyrido[1,2-a][1,3,5]triazin-2-yl}sulfanyl)acetamido]benzoate|ethyl 4-(2-((9-methyl-4-oxo-4H-pyrido[1,2-a][1,3,5]triazin-2-yl)thio)acetamido)benzoate|4-[[2-[(4-keto-9-methyl-pyrido[1,2-a][1,3,5]triazin-2-yl)thio]acetyl]amino]benzoic acid ethyl ester|4-[[2-[(9-methyl-4-oxo-2-pyrido[1,2-a][1,3,5]triazinyl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester|ethyl 4-[2-(9-methyl-4-oxidanylidene-pyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylethanoylamino]benzoate
| Molecular Formula | C19H18N4O4S |
|---|---|
| Molecular Weight | 398.1049 g/mol |
| LogP | 2.30542 |
| Topological Polar Surface Area | 102.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.1049 |
| Monoisotopic Mass | 398.1049 |
| Heavy Atoms | 28 |
| Complexity | 1079.479 |
Chemical Identifiers
| CAS Number | 896341-52-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)N3C=CC=C(C3=N2)C |
Product Overview
AC1OIWNU (CAS 896341-52-9), with molecular formula C19H18N4O4S and molecular weight 398.1049 g/mol. IUPAC: ethyl 4-[[2-(9-methyl-4-oxopyrido[1,2-a][1,3,5]triazin-2-yl)sulfanylacetyl]amino]benzoate.
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