Name: Name:6-bromo-4-cyclopentyl-7-fluoro-1,2,3,4-tetrahydroquinoxalin-2-one
Brand: Angene
SKU: AG01BC9S
Rating: 90 (10 reviews)

6-bromo-4-cyclopentyl-7-fluoro-1,2,3,4-tetrahydroquinoxalin-2-one

CAS No.:

1712902-48-1

Catalog Number:

AG01BC9S

Molecular Formula:

C13H14BrFN2O

Molecular Weight:

313.1655

Catalog Number:

AG01BC9S

Chemical Name:

6-bromo-4-cyclopentyl-7-fluoro-1,2,3,4-tetrahydroquinoxalin-2-one

CAS Number:

1712902-48-1

Molecular Formula:

C13H14BrFN2O

Molecular Weight:

313.1655

MDL Number:

MFCD28714753

IUPAC Name:

6-bromo-4-cyclopentyl-7-fluoro-1,3-dihydroquinoxalin-2-one

InChI:

InChI=1S/C13H14BrFN2O/c14-9-5-12-11(6-10(9)15)16-13(18)7-17(12)8-3-1-2-4-8/h5-6,8H,1-4,7H2,(H,16,18)

InChI Key:

QZLUNRNEZMARPF-UHFFFAOYSA-N

SMILES:

O=C1CN(C2CCCC2)c2c(N1)cc(c(c2)Br)F

Complexity:

335

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

312.027g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

313.17g/mol

Monoisotopic Mass:

312.027g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

32.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1