Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Encyclopedia > Hot Product Listed Z   > Z967355004
1280885-46-2 structure

Z967355004

Iupac Name:3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-(3-fluoro-5-morpholin-4-ylphenyl)propanamide
CAS No.:1280885-46-2
Molecular Weight:367.805g/mol
Molecular Formula:C17H19ClFN3O3 (isomer)
Names and Identifiers
Synonyms

3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-n-[3-fluoro-5-(morpholin-4-yl)phenyl]propanamide MCULE-1178299501 MOLPORT-019-674-609 ZINC65474827

Inchi
InChI=1S/C17H19ClFN3O3/c1-11-15(17(18)25-21-11)2-3-16(23)20-13-8-12(19)9-14(10-13)22-4-6-24-7-5-22/h8-10H,2-7H2,1H3,(H,20,23)
InChkey
QTOMBUFVJGJHKC-UHFFFAOYSA-N
Canonical Smiles
CC1=NOC(=C1CCC(=O)NC2=CC(=CC(=C2)N3CCOCC3)F)Cl
Computational chemical data
  • Molecular Weight:367.805g/molg/mol
  • Molecular Formula:C17H19ClFN3O3
  • Compound Is Canonicalized:True
  • Exact Mass:367.11
  • Monoisotopic Mass:367.11
  • Complexity:453
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:6
  • Topological Polar Surface Area:67.6A^2
  • Heavy Atom Count:25
  • 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: AAADceB7MQAEAAAAAAAAAAAAAAAAAWAAAAA8QAAAAAAAAAABwAAAHwIUAAAADArhni4yxJPQBACp A2V6UgCCAAAlJgAgmCE8btoKJjrB09OHMYhmlBjYyUeYHwIeAAAAAAQAAAAAAAAACAAAAAAAAAAA AA==
 
<