2,2'-(1,2-Ethenediyl)bis[5-[[4-[(2-methylphenyl)amino]-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]benzenesulfonic acid]
5-[[4-(2-methylanilino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-2-[2-[4-[[4-(2-methylanilino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid
| Molecular Formula | C42H44N12O8S2 |
|---|---|
| Molecular Weight | 909.0 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 276.0 A2 |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 14 |
| Exact Mass | 908.28467 |
| Heavy Atoms | 64 |
| Complexity | 1600.0 |
Chemical Identifiers
| CAS Number | 34372-32-2 |
|---|---|
| SMILES | CC1=CC=CC=C1NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)N6CCOCC6)NC7=CC=CC=C7C)S(=O)(=O)O)S(=O)(=O)O)N8CCOCC8 |
| InChIKey | TYMDEYSBAXREMJ-UHFFFAOYSA-N |
📖 Product Overview
2,2'-(1,2-Ethenediyl)bis[5-[[4-[(2-methylphenyl)amino]-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]benzenesulfonic acid] (CAS: 34372-32-2) is a chemical compound with molecular formula C42H44N12O8S2 and molecular weight 909.0 g/mol. Its IUPAC systematic name is 5-[[4-(2-methylanilino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-2-[2-[4-[[4-(2-methylanilino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid.
TYMDEYSBAXREMJ-UHFFFAOYSA-N.
SMILES: CC1=CC=CC=C1NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)N6CCOCC6)NC7=CC=CC=C7C)S(=O)(=O)O)S(=O)(=O)O)N8CCOCC8.
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