Name: Name:2-(4-(8-Bromo-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]quinolin-1-yl)phenyl)-2-methylpropanenitrile
Brand: Angene
SKU: AG006LLY
Rating: 90 (10 reviews)

2-(4-(8-Bromo-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]quinolin-1-yl)phenyl)-2-methylpropanenitrile

CAS No.:

915019-53-3

Catalog Number:

AG006LLY

Molecular Formula:

C20H15BrN4O

Molecular Weight:

407.2633

Catalog Number:

AG006LLY

Chemical Name:

2-(4-(8-Bromo-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]quinolin-1-yl)phenyl)-2-methylpropanenitrile

CAS Number:

915019-53-3

Molecular Formula:

C20H15BrN4O

Molecular Weight:

407.2633

MDL Number:

MFCD12406065

IUPAC Name:

2-[4-(8-bromo-2-oxo-3H-imidazo[4,5-c]quinolin-1-yl)phenyl]-2-methylpropanenitrile

InChI:

InChI=1S/C20H15BrN4O/c1-20(2,11-22)12-3-6-14(7-4-12)25-18-15-9-13(21)5-8-16(15)23-10-17(18)24-19(25)26/h3-10H,1-2H3,(H,24,26)

InChI Key:

VDJPWUIERGLWRZ-UHFFFAOYSA-N

SMILES:

N#CC(c1ccc(cc1)n1c(=O)[nH]c2c1c1cc(Br)ccc1nc2)(C)C

Complexity:

606

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

406.043g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

407.271g/mol

Monoisotopic Mass:

406.043g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8