4-cyclopropyl-3-[2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-one
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4-cyclopropyl-3-[2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-one
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CAS No:
732994-67-1
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Formula:
C20H22N4O3S
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Chemical Name:
4-cyclopropyl-3-[2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-one
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Synonyms:
ZINC3303771;AKOS034468187;MCULE-5114329597;AB00722464-01;SR-01000049077;SR-01000049077-1;Z56958578;4-cyclopropyl-3-({2-[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl}sulfanyl)-4,5-dihydro-1H-1,2,4-triazol-5-one;732994-67-1
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CAS No:
4-cyclopropyl-3-[2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-one Basic Attributes
398.5 g/mol
398.14126175 g/mol
Computed Properties
Molecular Weight:398.5
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:398.14126175
Monoisotopic Mass:398.14126175
Topological Polar Surface Area:101
Heavy Atom Count:28
Complexity:645
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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