3-[1-adamantylmethyl(3-methylbut-2-enoyl)amino]-8-formyl-4-hydroxy-N-(2-hydroxyethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide

Base Information

• Chemical Name: 3-[1-adamantylmethyl(3-methylbut-2-enoyl)amino]-8-formyl-4-hydroxy-N-(2-hydroxyethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
• CAS No.: 6106-13-4
• Molecular Formula: C19H12BrN5O3
• Molecular Weight: 438.2343
• DSSTox Substance ID: DTXSID00976554

Synonyms:6106-13-4;DTXSID00976554;3-{[(Adamantan-1-yl)methyl](3-methylbut-2-enoyl)amino}-8-formyl-4-hydroxy-N-(2-hydroxyethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboximidic acid

Chemical Property of 3-[1-adamantylmethyl(3-methylbut-2-enoyl)amino]-8-formyl-4-hydroxy-N-(2-hydroxyethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide

Chemical Property:

• Density: 1.65g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 578.29920168
• Heavy Atom Count: 42
• Complexity: 1090

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• Canonical SMILES: CC(=CC(=O)N(CC12CC3CC(C1)CC(C3)C2)C4C=C(C5C(C4O)OC6=C5C=C(C=C6OC)C=O)C(=O)NCCO)C

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