Name: Name:3-(4-Bromophenyl)-4-hydroxy-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carbonitrile
Brand: Angene
SKU: AG004W57
Rating: 90 (10 reviews)

3-(4-Bromophenyl)-4-hydroxy-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carbonitrile

CAS No.:

844499-56-5

Catalog Number:

AG004W57

Molecular Formula:

C14H7BrN2O2S

Molecular Weight:

347.1866

Catalog Number:

AG004W57

Chemical Name:

3-(4-Bromophenyl)-4-hydroxy-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carbonitrile

CAS Number:

844499-56-5

Molecular Formula:

C14H7BrN2O2S

Molecular Weight:

347.1866

MDL Number:

MFCD12032115

IUPAC Name:

3-(4-bromophenyl)-4-hydroxy-6-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile

InChI:

InChI=1S/C14H7BrN2O2S/c15-8-3-1-7(2-4-8)10-6-20-14-11(10)12(18)9(5-16)13(19)17-14/h1-4,6H,(H2,17,18,19)

InChI Key:

YSNMVWAZMAXLPE-UHFFFAOYSA-N

SMILES:

N#Cc1c(=O)[nH]c2c(c1O)c(cs2)c1ccc(cc1)Br

Complexity:

505

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

345.941g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

347.186g/mol

Monoisotopic Mass:

345.941g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5