Name: Name:methyl 4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
Brand: Angene
SKU: AG01A8DV
Rating: 90 (10 reviews)

methyl 4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

CAS No.:

1235439-30-1

Catalog Number:

AG01A8DV

Molecular Formula:

C7H10N4O2

Molecular Weight:

182.1799

Catalog Number:

AG01A8DV

Chemical Name:

methyl 4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

CAS Number:

1235439-30-1

Molecular Formula:

C7H10N4O2

Molecular Weight:

182.1799

MDL Number:

MFCD16040020

IUPAC Name:

methyl 4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

InChI:

InChI=1S/C7H10N4O2/c1-13-6(12)5-9-7-8-3-2-4-11(7)10-5/h2-4H2,1H3,(H,8,9,10)

InChI Key:

PMZDTUQFJNEQNX-UHFFFAOYSA-N

SMILES:

COC(=O)c1nn2c(n1)NCCC2

Complexity:

211

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

182.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

182.183g/mol

Monoisotopic Mass:

182.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6