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Home> Hot Product Listed 1   > 1H-Imidazole-1-acetamide,4-amino-N-hydroxy-(9CI)
1226442-80-3 structure

1H-Imidazole-1-acetamide,4-amino-N-hydroxy-(9CI)

Iupac Name:1,3-benzothiazol-2-yl-[4-(phenylmethoxymethyl)piperidin-1-yl]methanone
CAS No.:1226442-80-3
Molecular Weight:366.479
Molecular Formula:C11H10N2O3 (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1S/C21H22N2O2S/c24-21(20-22-18-8-4-5-9-19(18)26-20)23-12-10-17(11-13-23)15-25-14-16-6-2-1-3-7-16/h1-9,17H,10-15H2
InChkey
GOHCZCJRXWTXLF-UHFFFAOYSA-N
Canonical Smiles
C1CN(CCC1COCC2=CC=CC=C2)C(=O)C3=NC4=CC=CC=C4S3
Computational chemical data
  • Molecular Weight:366.479g/mol
  • Molecular Formula:C11H10N2O3
  • Compound Is Canonicalized:True
  • Exact Mass:366.14
  • Monoisotopic Mass:366.14
  • Complexity:461
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:70.7A^2
  • Heavy Atom Count:26
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB7MABAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAFgB9AAAHgQAAAAADQjh3gYwwbMIFAis AyVyVACD8KBjCjhImDy4bJgIZqLgsbmWMAhkxgHo6AewwCAOAAAAAAAAAQAAAAAAAAACAAAAAAAA AA==
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