2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]ethanone
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2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]ethanone
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CAS No:
744267-54-7
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Formula:
C18H19N5O3S
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Chemical Name:
2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]ethanone
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Synonyms:
ZINC02636439;ZINC5931854;AKOS033611326;MCULE-9463566162;Z18356772;2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-one;744267-54-7
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CAS No:
2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]ethanone Basic Attributes
385.4 g/mol
385.12086066 g/mol
Computed Properties
Molecular Weight:385.4
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:385.12086066
Monoisotopic Mass:385.12086066
Topological Polar Surface Area:133
Heavy Atom Count:27
Complexity:541
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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