SM6586
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SM6586
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CAS No:
103898-38-0
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Formula:
C26H27N5O5
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Chemical Name:
SM6586
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Synonyms:
SM 6586;3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-[3-[[methyl(phenylmethyl)amino]methyl]-1,2,4-oxadiazol-5-yl]-4-(3-nitrophenyl)-, methyl ester
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CAS No:
Characteristics
129.54000
3.63880
1.270±0.06 g/cm3
127-128 °C
624.0±65.0 °C(Predicted)
293.3ºC
1.635
1.25E-12mmHg at 25°C
5.10±0.50
Drug Information
methyl 1,4-dihydro-2,6-dimethyl-3-(3-N-benzyl-N-methylaminomethyl-1,2,4-oxadiazolyl-5-yl)-4-(3-nitrophenyl)pyridine-5-carboxylate
Computed Properties
Molecular Weight:489.5
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:489.20121898
Monoisotopic Mass:489.20121898
Topological Polar Surface Area:126
Heavy Atom Count:36
Complexity:878
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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