AC1NYDHC
methyl 4-[(3E)-3-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-4,5-dioxo-1-(1,3-thiazol-2-yl)pyrrolidin-2-yl]benzoate
Also Known As: methyl 4-(4-hydroxy-3-(4-((3-methylbenzyl)oxy)benzoyl)-5-oxo-1-(thiazol-2-yl)-2,5-dihydro-1H-pyrrol-2-yl)benzoate|methyl 4-[(3E)-3-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-4,5-dioxo-1-(1,3-thiazol-2-yl)pyrrolidin-2-yl]benzoate|methyl 4-[(3E)-3-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-4,5-dioxo-1-(1,3-thiazol-2-yl)pyrrolidin-2-yl]benzoate
| Molecular Formula | C30H24N2O6S |
|---|---|
| Molecular Weight | 540.1355 g/mol |
| LogP | 5.44342 |
| Topological Polar Surface Area | 106.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 540.1355 |
| Monoisotopic Mass | 540.1355 |
| Heavy Atoms | 39 |
| Complexity | 1560.0126 |
Chemical Identifiers
| CAS Number | 836624-32-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)COC2=CC=C(C=C2)/C(=C\3/C(N(C(=O)C3=O)C4=NC=CS4)C5=CC=C(C=C5)C(=O)OC)/O |
Product Overview
AC1NYDHC (CAS 836624-32-9), with molecular formula C30H24N2O6S and molecular weight 540.1355 g/mol. IUPAC: methyl 4-[(3E)-3-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-4,5-dioxo-1-(1,3-thiazol-2-yl)pyrrolidin-2-yl]benzoate.
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