methyl 4-[5-[(E)-[1-(3-chloro-4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoate
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methyl 4-[5-[(E)-[1-(3-chloro-4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoate
structure -
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CAS No:
353503-56-7
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Formula:
C22H14ClFN2O5
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Chemical Name:
methyl 4-[5-[(E)-[1-(3-chloro-4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoate
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Synonyms:
ZINC2309350;STK862935;AKOS000446808;(E)-methyl 4-(5-((1-(3-chloro-4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene)methyl)furan-2-yl)benzoate;353503-56-7;methyl 4-(5-{(E)-[1-(3-chloro-4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-2-furyl)benzoate;methyl 4-(5-{(E)-[1-(3-chloro-4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)benzoate
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CAS No:
methyl 4-[5-[(E)-[1-(3-chloro-4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoate Basic Attributes
440.8 g/mol
440.0575274 g/mol
Computed Properties
Molecular Weight:440.8
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:440.0575274
Monoisotopic Mass:440.0575274
Topological Polar Surface Area:88.8
Heavy Atom Count:31
Complexity:754
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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