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Home> Hot Product Listed T   > Thiazolo[3,2-a]benzimidazole-2-carboxamide,6-amino-N-cyclohexyl-N,3-dimethyl-
1188265-21-5 structure

Thiazolo[3,2-a]benzimidazole-2-carboxamide,6-amino-N-cyclohexyl-N,3-dimethyl-

Iupac Name:1-benzylpyrrolidine-3-carbonitrile;oxalic acid
CAS No.:1188265-21-5
Molecular Weight:276.292
Molecular Formula:C38H48N3O8P (isomer)
Names and Identifiers
Synonyms

YM 298198

Inchi
InChI=1S/C12H14N2.C2H2O4/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11;3-1(4)2(5)6/h1-5,12H,6-7,9-10H2;(H,3,4)(H,5,6)
InChkey
NLBJMBNDZZMLDI-UHFFFAOYSA-N
Canonical Smiles
C1CN(CC1C#N)CC2=CC=CC=C2.C(=O)(C(=O)O)O
Properties
Storage temp
Desiccate at +4°C
Computational chemical data
  • Molecular Weight:276.292g/mol
  • Molecular Formula:C38H48N3O8P
  • Compound Is Canonicalized:True
  • Exact Mass:276.111
  • Monoisotopic Mass:276.111
  • Complexity:293
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:6
  • Topological Polar Surface Area:102A^2
  • Heavy Atom Count:20
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
  • CACTVS Substructure Key Fingerprint: AAADceBzOAAAAAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAAABAAAAHgAACAAADQDBmAQwCIMAAgCY BiDSCAKCAAAgAAAIiABIBIgJoCKAkRGEIAhggACJiA8QgAAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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