Name: Name:3-[5-amino-2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]butan-1-ol
Brand: Angene
SKU: AG01AUCL
Rating: 90 (10 reviews)

3-[5-amino-2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]butan-1-ol

CAS No.:

1551360-20-3

Catalog Number:

AG01AUCL

Molecular Formula:

C12H14F3N3O

Molecular Weight:

273.2543

Catalog Number:

AG01AUCL

Chemical Name:

3-[5-amino-2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]butan-1-ol

CAS Number:

1551360-20-3

Molecular Formula:

C12H14F3N3O

Molecular Weight:

273.2543

MDL Number:

MFCD25892525

IUPAC Name:

3-[5-amino-2-(trifluoromethyl)benzimidazol-1-yl]butan-1-ol

InChI:

InChI=1S/C12H14F3N3O/c1-7(4-5-19)18-10-3-2-8(16)6-9(10)17-11(18)12(13,14)15/h2-3,6-7,19H,4-5,16H2,1H3

InChI Key:

MBPXXENMXMNZPW-UHFFFAOYSA-N

SMILES:

OCCC(n1c2ccc(cc2nc1C(F)(F)F)N)C

Complexity:

313

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

273.109g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

273.259g/mol

Monoisotopic Mass:

273.109g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7