Name: Name:3-(4-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid
Brand: Angene
SKU: AG01DVGY
Rating: 90 (10 reviews)

3-(4-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid

CAS No.:

1512184-59-6

Catalog Number:

AG01DVGY

Molecular Formula:

C13H12FN3O2

Molecular Weight:

261.2517

Catalog Number:

AG01DVGY

Chemical Name:

3-(4-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid

CAS Number:

1512184-59-6

Molecular Formula:

C13H12FN3O2

Molecular Weight:

261.2517

MDL Number:

MFCD23579316

IUPAC Name:

3-(4-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid

InChI:

InChI=1S/C13H12FN3O2/c14-10-4-1-8(2-5-10)12-16-15-11-6-3-9(13(18)19)7-17(11)12/h1-2,4-5,9H,3,6-7H2,(H,18,19)

InChI Key:

WQOKHMRIBWKRDT-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCc2n(C1)c(nn2)c1ccc(cc1)F

Complexity:

347

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

261.091g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

261.256g/mol

Monoisotopic Mass:

261.091g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1