Name: Name:12-oxa-2,3,5,7-tetraazatricyclo[7.4.0.0,2,6]trideca-1(9),3,5,7-tetraen-13-one
Brand: Angene
SKU: AG019LD5
Rating: 90 (10 reviews)

12-oxa-2,3,5,7-tetraazatricyclo[7.4.0.0,2,6]trideca-1(9),3,5,7-tetraen-13-one

CAS No.:

1000932-07-9

Catalog Number:

AG019LD5

Molecular Formula:

C8H6N4O2

Molecular Weight:

190.1588

Catalog Number:

AG019LD5

Chemical Name:

12-oxa-2,3,5,7-tetraazatricyclo[7.4.0.0,2,6]trideca-1(9),3,5,7-tetraen-13-one

CAS Number:

1000932-07-9

Molecular Formula:

C8H6N4O2

Molecular Weight:

190.1588

MDL Number:

MFCD09863426

IUPAC Name:

12-oxa-2,3,5,7-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7-tetraen-13-one

InChI:

InChI=1S/C8H6N4O2/c13-7-6-5(1-2-14-7)3-9-8-10-4-11-12(6)8/h3-4H,1-2H2

InChI Key:

VTFYQBSWPWKVSM-UHFFFAOYSA-N

SMILES:

O=C1OCCc2c1n1ncnc1nc2

Complexity:

260

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.049g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.162g/mol

Monoisotopic Mass:

190.049g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3