AC1NWSED

methyl 4-[(3E)-1-[2-(diethylamino)ethyl]-3-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-4,5-dioxopyrrolidin-2-yl]benzoate

Also Known As: Oprea1_449293|methyl 4-(1-(2-(diethylamino)ethyl)-4-hydroxy-3-(4-isopropoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate|methyl 4-(1-[2-(diethylamino)ethyl]-4-hydroxy-3-{[4-(methylethoxy)phenyl]carbo nyl}-5-oxo-3-pyrrolin-2-yl)benzoate|methyl 4-(1-[2-(diethylamino)ethyl]-4-hydroxy-5-oxo-3-{[4-(propan-2-yloxy)phenyl]carbonyl}-2,5-dihydro-1H-pyrrol-2-yl)benzoate|methyl 4-[(3E)-1-(2-diethylaminoethyl)-3-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-4,5-dioxopyrrolidin-2-yl]benzoate|methyl 4-[(3E)-1-[2-(diethylamino)ethyl]-3-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-4,5-dioxopyrrolidin-2-yl]benzoate

Molecular Formula	C28H34N2O6
Molecular Weight	494.2417 g/mol
LogP	4.0239
Topological Polar Surface Area	96.38 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	10
Exact Mass	494.2417
Monoisotopic Mass	494.2417
Heavy Atoms	36
Complexity	1117.7339

Chemical Identifiers

CAS Number	384366-17-0
SMILES	CCN(CC)CCN1C(/C(=C(/C2=CC=C(C=C2)OC(C)C)\O)/C(=O)C1=O)C3=CC=C(C=C3)C(=O)OC