[2-(benzylamino)-2-oxoethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate
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[2-(benzylamino)-2-oxoethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate
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CAS No:
475253-50-0
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Formula:
C19H17N5O5S
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Chemical Name:
[2-(benzylamino)-2-oxoethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate
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Synonyms:
ZINC3245315;AKOS033667858;MCULE-7391069311;Z19255731;(benzylcarbamoyl)methyl 4-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate;475253-50-0
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CAS No:
[2-(benzylamino)-2-oxoethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate Basic Attributes
427.4 g/mol
427.09503983 g/mol
Computed Properties
Molecular Weight:427.4
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:427.09503983
Monoisotopic Mass:427.09503983
Topological Polar Surface Area:157
Heavy Atom Count:30
Complexity:613
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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