Name: Name:2-amino-3-(5,6-difluoro-1H-1,3-benzodiazol-1-yl)propanoic acid
Brand: Angene
SKU: AG01BH4L
Rating: 90 (10 reviews)

2-amino-3-(5,6-difluoro-1H-1,3-benzodiazol-1-yl)propanoic acid

CAS No.:

1477584-19-2

Catalog Number:

AG01BH4L

Molecular Formula:

C10H9F2N3O2

Molecular Weight:

241.1942

Catalog Number:

AG01BH4L

Chemical Name:

2-amino-3-(5,6-difluoro-1H-1,3-benzodiazol-1-yl)propanoic acid

CAS Number:

1477584-19-2

Molecular Formula:

C10H9F2N3O2

Molecular Weight:

241.1942

MDL Number:

MFCD20808510

IUPAC Name:

2-amino-3-(5,6-difluorobenzimidazol-1-yl)propanoic acid

InChI:

InChI=1S/C10H9F2N3O2/c11-5-1-8-9(2-6(5)12)15(4-14-8)3-7(13)10(16)17/h1-2,4,7H,3,13H2,(H,16,17)

InChI Key:

NUEDGDWGYOXQQD-UHFFFAOYSA-N

SMILES:

NC(C(=O)O)Cn1cnc2c1cc(F)c(c2)F

Complexity:

305

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.066g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.198g/mol

Monoisotopic Mass:

241.066g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-2