AC1NT3BB
(5E)-5-[[4-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]-3-methoxyphenyl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: CBMicro_021249|BIM-0021150.P001|AM-879/12634002|(5E)-5-[[4-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]-3-methoxyphenyl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one|(5E)-5-[(4-{[4,6-BIS(MORPHOLIN-4-YL)-1,3,5-TRIAZIN-2-YL]OXY}-3-METHOXYPHENYL)METHYLIDENE]-3-PHENYL-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE|5-(4-{[4,6-di(4-morpholinyl)-1,3,5-triazin-2-yl]oxy}-3-methoxybenzylidene)-3-phenyl-2-thioxo-1,3-thiazolidin-4-one|(5E)-5-(4-{[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-3-methoxybenzylidene)-3-phenyl-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C28H28N6O5S2 |
|---|---|
| Molecular Weight | 592.15625 g/mol |
| LogP | 3.7515 |
| Topological Polar Surface Area | 102.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 592.15625 |
| Monoisotopic Mass | 592.15625 |
| Heavy Atoms | 41 |
| Complexity | 1425.3315 |
Chemical Identifiers
| CAS Number | 5839-29-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)C3=CC=CC=C3)OC4=NC(=NC(=N4)N5CCOCC5)N6CCOCC6 |
Product Overview
AC1NT3BB (CAS 5839-29-2), with molecular formula C28H28N6O5S2 and molecular weight 592.15625 g/mol. IUPAC: (5E)-5-[[4-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]-3-methoxyphenyl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one.