Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed F   > F5447-0011
874594-85-1 structure

F5447-0011

Iupac Name:2-[(2-chloroacetyl)-ethylamino]-N-(thiophen-2-ylmethyl)acetamide
CAS No.:874594-85-1
Molecular Weight:274.763
Molecular Formula:C18H22N2O4S (isomer)
Names and Identifiers
Synonyms

AKOS024267531 MCULE-8619781068 methyl 1-(1,1-dioxo-1??-thiolan-3-yl)-6-(4-acetamidophenyl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate methyl 6-(4-acetamidophenyl)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methyl-1h-pyrazolo[3,4-b]pyridine-4-carboxylate MOLPORT-009-732-518 VU0643135-1

Inchi
InChI=1S/C11H15ClN2O2S/c1-2-14(11(16)6-12)8-10(15)13-7-9-4-3-5-17-9/h3-5H,2,6-8H2,1H3,(H,13,15)
InChkey
IWMHRSUQUFCOTK-UHFFFAOYSA-N
Canonical Smiles
CCN(CC(=O)NCC1=CC=CS1)C(=O)CCl
Computational chemical data
  • Molecular Weight:274.763g/mol
  • Molecular Formula:C18H22N2O4S
  • Compound Is Canonicalized:True
  • Exact Mass:274.054
  • Monoisotopic Mass:274.054
  • Complexity:276
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:77.6A^2
  • Heavy Atom Count:17
  • 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: AAADccBzMABEAAAAAAAAAAAAAAAAASAAAAAAAAAAAAAAAAABgAAAHgYQAAAACAPF0ESyAYPAAAiM ACFSEACDAIAgCBBIiJiIBIhIYCKgkTHUAAhglgCoiAYQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
Recommended Suppliers
 
<