Name: Name:3,5-Pyridinedicarboxylic acid,4-(4-chlorophenyl)-1,4-dihydro-2,6-dimethyl-, dimethyl ester
Brand: Angene
SKU: AG00ICDQ
Rating: 90 (10 reviews)

3,5-Pyridinedicarboxylic acid,4-(4-chlorophenyl)-1,4-dihydro-2,6-dimethyl-, dimethyl ester

CAS No.:

73257-49-5

Catalog Number:

AG00ICDQ

Molecular Formula:

C17H18ClNO4

Molecular Weight:

335.7821

Catalog Number:

AG00ICDQ

Chemical Name:

3,5-Pyridinedicarboxylic acid,4-(4-chlorophenyl)-1,4-dihydro-2,6-dimethyl-, dimethyl ester

CAS Number:

73257-49-5

Molecular Formula:

C17H18ClNO4

Molecular Weight:

335.7821

MDL Number:

MFCD00619418

IUPAC Name:

dimethyl 4-(4-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

InChI:

InChI=1S/C17H18ClNO4/c1-9-13(16(20)22-3)15(11-5-7-12(18)8-6-11)14(10(2)19-9)17(21)23-4/h5-8,15,19H,1-4H3

InChI Key:

XBDJVUHXRNRICA-UHFFFAOYSA-N

SMILES:

COC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC)C

Complexity:

521

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

335.092g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

335.784g/mol

Monoisotopic Mass:

335.092g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3