Name: Name:3-benzyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine
Brand: Angene
SKU: AG01AKXC
Rating: 90 (10 reviews)

3-benzyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine

CAS No.:

1035454-21-7

Catalog Number:

AG01AKXC

Molecular Formula:

C12H14N4

Molecular Weight:

214.2664

Catalog Number:

AG01AKXC

Chemical Name:

3-benzyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine

CAS Number:

1035454-21-7

Molecular Formula:

C12H14N4

Molecular Weight:

214.2664

MDL Number:

MFCD11856751

IUPAC Name:

3-benzyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine

InChI:

InChI=1S/C12H14N4/c1-2-4-10(5-3-1)8-11-14-15-12-9-13-6-7-16(11)12/h1-5,13H,6-9H2

InChI Key:

UIEIJYMITLIXQW-UHFFFAOYSA-N

SMILES:

c1ccc(cc1)Cc1nnc2n1CCNC2

Complexity:

227

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.122g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.272g/mol

Monoisotopic Mass:

214.122g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5