Name: Name:1-(chloromethyl)-4-ethyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Brand: Angene
SKU: AG019PC7
Rating: 90 (10 reviews)

1-(chloromethyl)-4-ethyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-5-one

CAS No.:

86662-61-5

Catalog Number:

AG019PC7

Molecular Formula:

C12H11ClN4O

Molecular Weight:

262.6949

Catalog Number:

AG019PC7

Chemical Name:

1-(chloromethyl)-4-ethyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-5-one

CAS Number:

86662-61-5

Molecular Formula:

C12H11ClN4O

Molecular Weight:

262.6949

MDL Number:

MFCD08547705

IUPAC Name:

1-(chloromethyl)-4-ethyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

InChI:

InChI=1S/C12H11ClN4O/c1-2-16-11(18)8-5-3-4-6-9(8)17-10(7-13)14-15-12(16)17/h3-6H,2,7H2,1H3

InChI Key:

NZZGIXHVHWTYRY-UHFFFAOYSA-N

SMILES:

ClCc1nnc2n1c1ccccc1c(=O)n2CC

Complexity:

340

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

262.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

262.697g/mol

Monoisotopic Mass:

262.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3