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Home > Encyclopedia > cyanomethyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylate

cyanomethyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylate

cyanomethyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylate structure

cyanomethyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylate 

structure
  • CAS No:

    733763-66-1

  • Formula:

    C17H13N3O5S

  • Chemical Name:

    cyanomethyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylate

  • Synonyms:

    ZINC3332339;AKOS033432022;MCULE-3584829416;Z15661121;cyanomethyl 2-({[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}sulfanyl)pyridine-3-carboxylate;733763-66-1

cyanomethyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Basic Attributes

371.4 g/mol

371.05759170 g/mol

Characteristics

136 Ų

Computed Properties

Molecular Weight:371.4
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:371.05759170
Monoisotopic Mass:371.05759170
Topological Polar Surface Area:136
Heavy Atom Count:26
Complexity:566
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of cyanomethyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylate

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