AC1NRALP
3-[5-[(5-cyano-1,4-dimethyl-2-morpholin-4-yl-6-oxo-3-pyridinyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: 3-(5-{[5-Cyano-1,4-dimethyl-2-(morpholin-4-yl)-6-oxo-1,6-dihydropyridin-3-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid|3-[5-[(5-cyano-1,4-dimethyl-2-morpholin-4-yl-6-oxopyridin-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
| Molecular Formula | C19H20N4O5S2 |
|---|---|
| Molecular Weight | 448.08752 g/mol |
| LogP | 1.0779 |
| Topological Polar Surface Area | 115.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.08752 |
| Monoisotopic Mass | 448.08752 |
| Heavy Atoms | 30 |
| Complexity | 1050.4752 |
Chemical Identifiers
| CAS Number | 7063-16-3 |
|---|---|
| SMILES | CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC(=O)O)N3CCOCC3)C)C#N |
Product Overview
AC1NRALP (CAS 7063-16-3), with molecular formula C19H20N4O5S2 and molecular weight 448.08752 g/mol. IUPAC: 3-[5-[(5-cyano-1,4-dimethyl-2-morpholin-4-yl-6-oxo-3-pyridinyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid.
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