Name: Name:5-{[(2,6-dichloropyridin-4-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
Brand: Angene
SKU: AG01ACTS
Rating: 90 (10 reviews)

5-{[(2,6-dichloropyridin-4-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione

CAS No.:

863785-65-3

Catalog Number:

AG01ACTS

Molecular Formula:

C12H10Cl2N2O4

Molecular Weight:

317.1248

Catalog Number:

AG01ACTS

Chemical Name:

5-{[(2,6-dichloropyridin-4-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione

CAS Number:

863785-65-3

Molecular Formula:

C12H10Cl2N2O4

Molecular Weight:

317.1248

MDL Number:

MFCD26395999

IUPAC Name:

5-[[(2,6-dichloropyridin-4-yl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione

InChI:

InChI=1S/C12H10Cl2N2O4/c1-12(2)19-10(17)7(11(18)20-12)5-15-6-3-8(13)16-9(14)4-6/h3-5H,1-2H3,(H,15,16)

InChI Key:

MGRIBXWIJKRRKZ-UHFFFAOYSA-N

SMILES:

O=C1OC(C)(C)OC(=O)C1=CNc1cc(Cl)nc(c1)Cl

Complexity:

421

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

316.002g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

317.122g/mol

Monoisotopic Mass:

316.002g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3