Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed 3   > 3-[2-(cyclopentylsulfanyl)ethyl]-1-[2-(1h-pyrazol-1-yl)pyridin-3-yl]urea
1306738-41-9 structure

3-[2-(cyclopentylsulfanyl)ethyl]-1-[2-(1h-pyrazol-1-yl)pyridin-3-yl]urea

Iupac Name:[4-(1,2,4-oxadiazol-3-yl)phenyl]methanamine
CAS No.:1306738-41-9
Molecular Weight:175.191
Molecular Formula:C18H20N4O2 (isomer)
Names and Identifiers
Synonyms

MCULE-6512136807 MOLPORT-019-657-072 Z434643768 ZINC48197423

Inchi
InChI=1S/C9H9N3O/c10-5-7-1-3-8(4-2-7)9-11-6-13-12-9/h1-4,6H,5,10H2
InChkey
VRTGDVLIPISYLR-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=CC=C1CN)C2=NOC=N2
Computational chemical data
  • Molecular Weight:175.191g/mol
  • Molecular Formula:C18H20N4O2
  • Compound Is Canonicalized:True
  • Exact Mass:175.075
  • Monoisotopic Mass:175.075
  • Complexity:157
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:64.9A^2
  • Heavy Atom Count:13
  • 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: AAADccBzIAAAAAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAAABwAAAHgAUAAAADADBGwY1EIZYEACp AiJjtgCCgAkwAKApyKAoBJiIKKKAkRGEIAhghQAIiAcQgAAOQAAAAAAAAACAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:+86 021-51698675
  • Fax:
 
<