Name: Name:1-(1-methoxypropan-2-yl)-2-(trifluoromethyl)-1H-1,3-benzodiazol-5-amine
Brand: Angene
SKU: AG01AUDX
Rating: 90 (10 reviews)

1-(1-methoxypropan-2-yl)-2-(trifluoromethyl)-1H-1,3-benzodiazol-5-amine

CAS No.:

1465247-69-1

Catalog Number:

AG01AUDX

Molecular Formula:

C12H14F3N3O

Molecular Weight:

273.2543

Catalog Number:

AG01AUDX

Chemical Name:

1-(1-methoxypropan-2-yl)-2-(trifluoromethyl)-1H-1,3-benzodiazol-5-amine

CAS Number:

1465247-69-1

Molecular Formula:

C12H14F3N3O

Molecular Weight:

273.2543

MDL Number:

MFCD17085313

IUPAC Name:

1-(1-methoxypropan-2-yl)-2-(trifluoromethyl)benzimidazol-5-amine

InChI:

InChI=1S/C12H14F3N3O/c1-7(6-19-2)18-10-4-3-8(16)5-9(10)17-11(18)12(13,14)15/h3-5,7H,6,16H2,1-2H3

InChI Key:

FBNUXQYPAQIIGR-UHFFFAOYSA-N

SMILES:

COCC(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:

53.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9