[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
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[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
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CAS No:
756868-49-2
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Formula:
C18H18N2O6S
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Chemical Name:
[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
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Synonyms:
MLS000335921;CHEMBL1477791;HMS2525I24;ZINC2661176;AKOS033631208;SMR000253675;Z18553743;3-[({[4-cyclopropyl-3-(ethoxycarbonyl)thiophen-2-yl]carbamoyl}methoxy)carbonyl]pyridin-1-ium-1-olate;756868-49-2
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CAS No:
[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate Basic Attributes
390.4 g/mol
390.08855747 g/mol
Computed Properties
Molecular Weight:390.4
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:390.08855747
Monoisotopic Mass:390.08855747
Topological Polar Surface Area:135
Heavy Atom Count:27
Complexity:570
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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