Name: Name:ethyl 3-hydroxy-5H,6H,7H,8H-pyrido[4,3-c]pyridazine-6-carboxylate
Brand: Angene
SKU: AG01AIN6
Rating: 90 (10 reviews)

ethyl 3-hydroxy-5H,6H,7H,8H-pyrido[4,3-c]pyridazine-6-carboxylate

CAS No.:

39716-48-8

Catalog Number:

AG01AIN6

Molecular Formula:

C10H13N3O3

Molecular Weight:

223.2285

Catalog Number:

AG01AIN6

Chemical Name:

ethyl 3-hydroxy-5H,6H,7H,8H-pyrido[4,3-c]pyridazine-6-carboxylate

CAS Number:

39716-48-8

Molecular Formula:

C10H13N3O3

Molecular Weight:

223.2285

MDL Number:

MFCD18916428

IUPAC Name:

ethyl 3-oxo-2,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6-carboxylate

InChI:

InChI=1S/C10H13N3O3/c1-2-16-10(15)13-4-3-8-7(6-13)5-9(14)12-11-8/h5H,2-4,6H2,1H3,(H,12,14)

InChI Key:

LBUWFLGJLUHKJK-UHFFFAOYSA-N

SMILES:

CCOC(=O)N1CCc2c(C1)cc(nn2)O

Complexity:

387

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

223.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

223.232g/mol

Monoisotopic Mass:

223.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.6