2-[[4-[[4-(dimethylamino)phenyl]methylideneamino]-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid
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2-[[4-[[4-(dimethylamino)phenyl]methylideneamino]-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid
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CAS No:
561011-14-1
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Formula:
C20H21N5O3S
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Chemical Name:
2-[[4-[[4-(dimethylamino)phenyl]methylideneamino]-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid
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Synonyms:
AKOS034466397;MCULE-9162678316;Z56930676;2-{[4-({[4-(dimethylamino)phenyl]methylidene}amino)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid;561011-14-1
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CAS No:
2-[[4-[[4-(dimethylamino)phenyl]methylideneamino]-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Basic Attributes
411.5 g/mol
411.13651072 g/mol
Computed Properties
Molecular Weight:411.5
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:411.13651072
Monoisotopic Mass:411.13651072
Topological Polar Surface Area:118
Heavy Atom Count:29
Complexity:556
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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