Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed F   > F5033-4522
306-44-5 structure

F5033-4522

CAS No.:306-44-5
Molecular Weight:87.0773
Molecular Formula:C19H24N4O2S (isomer)
Names and Identifiers
Synonyms

2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1h-purin-7(6h)-yl)-n-((1-(4-methyl-1,2,3-thiadiazole-5-carbonyl)piperidin-4-yl)methyl)acetamide AKOS024492305 MCULE-7072257268 MOLPORT-019-918-914 VU0631491-1 ZINC43987151

Inchi
InChI=1/C3H5NO2/c1-3(5)2-4-6/h2,6H,1H3/b4-2+
Canonical Smiles
CC(=O)C=NO
Isomers Smiles
CC(=O)/C=N/O
Properties
Refractive Index
1.445
HS Code
2928000090
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:87.0773g/mol
  • Molecular Formula:C19H24N4O2S
  • XLogP3-AA:0.4
  • Exact Mass:87.032028
  • Monoisotopic Mass:87.032028
  • Complexity:76.9
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:49.7
  • Heavy Atom Count:6
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:1
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
Recommended Suppliers
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:+86-571-85378921
  • Fax:
Recommended Suppliers
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:+86-571-85378921
  • Fax:
 
<