Name: Name:tert-butyl 5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxylate
Brand: Angene
SKU: AG01C4EF
Rating: 90 (10 reviews)

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

CAS No.:

1989659-06-4

Catalog Number:

AG01C4EF

Molecular Formula:

C10H16N4O2

Molecular Weight:

224.2596

Catalog Number:

AG01C4EF

Chemical Name:

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

CAS Number:

1989659-06-4

Molecular Formula:

C10H16N4O2

Molecular Weight:

224.2596

MDL Number:

MFCD30342722

IUPAC Name:

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

InChI:

InChI=1S/C10H16N4O2/c1-10(2,3)16-9(15)7-5-14-6-12-13-8(14)4-11-7/h6-7,11H,4-5H2,1-3H3

InChI Key:

GGKBKNTXWMASNL-UHFFFAOYSA-N

SMILES:

O=C(C1NCc2n(C1)cnn2)OC(C)(C)C

Complexity:

277

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.264g/mol

Monoisotopic Mass:

224.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.5