Name: Name:tert-butyl 7-chloro-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylate
Brand: Angene
SKU: AG003957
Rating: 90 (10 reviews)

tert-butyl 7-chloro-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylate

CAS No.:

1060816-50-3

Catalog Number:

AG003957

Molecular Formula:

C13H17ClN2O2

Molecular Weight:

268.7393

Catalog Number:

AG003957

Chemical Name:

tert-butyl 7-chloro-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylate

CAS Number:

1060816-50-3

Molecular Formula:

C13H17ClN2O2

Molecular Weight:

268.7393

MDL Number:

MFCD13189403

IUPAC Name:

tert-butyl 7-chloro-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylate

InChI:

InChI=1S/C13H17ClN2O2/c1-13(2,3)18-12(17)16-5-4-9-7-15-11(14)6-10(9)8-16/h6-7H,4-5,8H2,1-3H3

InChI Key:

KWEUYGQXJOTAGR-UHFFFAOYSA-N

SMILES:

O=C(N1CCc2c(C1)cc(nc2)Cl)OC(C)(C)C

Complexity:

317

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

268.098g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

268.741g/mol

Monoisotopic Mass:

268.098g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5