VER-49009
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VER-49009
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CAS No:
940289-57-6
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Formula:
C19H18ClN3O4
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Chemical Name:
VER-49009
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Synonyms:
VER-49009;CCT0129397;3-(5-chloro-2,4-dihydroxyphenyl)-N-ethyl-4-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide;5-(3-chloro-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-n-ethyl-4-(4-methoxyphenyl)-1,2-dihydropyrazole-3-carboxamide
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CAS No:
Description
5-(5-chloro-2,4-dihydroxyphenyl)-N-ethyl-4-(4-methoxyphenyl)pyrazole-3-carboxamide is an aromatic amide obtained by formal condensation of the carboxy group of 5-(5-chloro-2,4-dihydroxyphenyl)-4-(4-methoxyphenyl)pyrazole-3-carboxylic acid with the amino group of ethylamine. It has a role as a Hsp90 inhibitor. It is a member of pyrazoles, a member of resorcinols, a member of monochlorobenzenes, a monomethoxybenzene and an aromatic amide.
Computed Properties
Molecular Weight:387.8
XLogP3:3.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:387.0985838
Monoisotopic Mass:387.0985838
Topological Polar Surface Area:108
Heavy Atom Count:27
Complexity:503
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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