Name: Name:3-hydroxy-2-(thiophen-2-yl)-7-(trifluoromethyl)-1,4-dihydroquinolin-4-one
Brand: Angene
SKU: AG01B1T0
Rating: 90 (10 reviews)

3-hydroxy-2-(thiophen-2-yl)-7-(trifluoromethyl)-1,4-dihydroquinolin-4-one

CAS No.:

851268-40-1

Catalog Number:

AG01B1T0

Molecular Formula:

C14H8F3NO2S

Molecular Weight:

311.2790

Catalog Number:

AG01B1T0

Chemical Name:

3-hydroxy-2-(thiophen-2-yl)-7-(trifluoromethyl)-1,4-dihydroquinolin-4-one

CAS Number:

851268-40-1

Molecular Formula:

C14H8F3NO2S

Molecular Weight:

311.2790

MDL Number:

MFCD06376666

IUPAC Name:

3-hydroxy-2-thiophen-2-yl-7-(trifluoromethyl)-1H-quinolin-4-one

InChI:

InChI=1S/C14H8F3NO2S/c15-14(16,17)7-3-4-8-9(6-7)18-11(13(20)12(8)19)10-2-1-5-21-10/h1-6,20H,(H,18,19)

InChI Key:

JUBOFCBKNISZSS-UHFFFAOYSA-N

SMILES:

Oc1c([nH]c2c(c1=O)ccc(c2)C(F)(F)F)c1cccs1

Complexity:

477

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

311.023g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

311.278g/mol

Monoisotopic Mass:

311.023g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6