200,000+ products from a single source!
sales@angenechem.com
873443-71-1 | 3-PYRIDINECARBONITRILE, 2-CHLORO-6-(1,1-DIOXIDO-4-THIOMORPHOLINYL)-4-(4-FLUORO-2-METHYLPHENYL)-
CAS No: 873443-71-1 Catalog No: AG004HI9 MDL No:
Product Description
Catalog Number:
AG004HI9
Chemical Name:
3-PYRIDINECARBONITRILE, 2-CHLORO-6-(1,1-DIOXIDO-4-THIOMORPHOLINYL)-4-(4-FLUORO-2-METHYLPHENYL)-
CAS Number:
873443-71-1
Molecular Formula:
C17H15ClFN3O2S
Molecular Weight:
379.8363
IUPAC Name:
2-chloro-6-(1,1-dioxo-1,4-thiazinan-4-yl)-4-(4-fluoro-2-methylphenyl)pyridine-3-carbonitrile
InChI:
InChI=1S/C17H15ClFN3O2S/c1-11-8-12(19)2-3-13(11)14-9-16(21-17(18)15(14)10-20)22-4-6-25(23,24)7-5-22/h2-3,8-9H,4-7H2,1H3
InChI Key:
YLGCDHHCFRXHNL-UHFFFAOYSA-N
SMILES:
N#Cc1c(Cl)nc(cc1c1ccc(cc1C)F)N1CCS(=O)(=O)CC1
Properties
Complexity:
618
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.056g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
379.834g/mol
Monoisotopic Mass:
379.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.