Name: Name:methyl 5-chloro-1-(4-chlorophenyl)-4-oxo-1,4-dihydrocinnoline-3-carboxylate
Brand: Angene
SKU: AG01DFNA
Rating: 90 (10 reviews)

methyl 5-chloro-1-(4-chlorophenyl)-4-oxo-1,4-dihydrocinnoline-3-carboxylate

CAS No.:

146743-26-2

Catalog Number:

AG01DFNA

Molecular Formula:

C16H10Cl2N2O3

Molecular Weight:

349.1682

Catalog Number:

AG01DFNA

Chemical Name:

methyl 5-chloro-1-(4-chlorophenyl)-4-oxo-1,4-dihydrocinnoline-3-carboxylate

CAS Number:

146743-26-2

Molecular Formula:

C16H10Cl2N2O3

Molecular Weight:

349.1682

MDL Number:

MFCD31652419

IUPAC Name:

methyl 5-chloro-1-(4-chlorophenyl)-4-oxocinnoline-3-carboxylate

InChI:

InChI=1S/C16H10Cl2N2O3/c1-23-16(22)14-15(21)13-11(18)3-2-4-12(13)20(19-14)10-7-5-9(17)6-8-10/h2-8H,1H3

InChI Key:

LZGOFHUDCCGVQH-UHFFFAOYSA-N

SMILES:

COC(=O)c1nn(c2ccc(cc2)Cl)c2c(c1=O)c(Cl)ccc2

Complexity:

518

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

348.007g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

349.167g/mol

Monoisotopic Mass:

348.007g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.5