Name: Name:1-(furan-2-ylmethyl)-5-(trifluoromethyl)-1H-1,3-benzodiazol-2-amine
Brand: Angene
SKU: AG019PLJ
Rating: 90 (10 reviews)

1-(furan-2-ylmethyl)-5-(trifluoromethyl)-1H-1,3-benzodiazol-2-amine

CAS No.:

878259-07-5

Catalog Number:

AG019PLJ

Molecular Formula:

C13H10F3N3O

Molecular Weight:

281.2332

Catalog Number:

AG019PLJ

Chemical Name:

1-(furan-2-ylmethyl)-5-(trifluoromethyl)-1H-1,3-benzodiazol-2-amine

CAS Number:

878259-07-5

Molecular Formula:

C13H10F3N3O

Molecular Weight:

281.2332

MDL Number:

MFCD08246113

IUPAC Name:

1-(furan-2-ylmethyl)-5-(trifluoromethyl)benzimidazol-2-amine

InChI:

InChI=1S/C13H10F3N3O/c14-13(15,16)8-3-4-11-10(6-8)18-12(17)19(11)7-9-2-1-5-20-9/h1-6H,7H2,(H2,17,18)

InChI Key:

QYVPLFHAOLRMBY-UHFFFAOYSA-N

SMILES:

Nc1nc2c(n1Cc1ccco1)ccc(c2)C(F)(F)F

Complexity:

352

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.078g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

281.238g/mol

Monoisotopic Mass:

281.078g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7