Name: Name:3-benzyl-4-oxo-3H,4H-imidazo[4,3-d][1,2,3,5]tetrazine-8-carboxamide
Brand: Angene
SKU: AG01C5RD
Rating: 90 (10 reviews)

3-benzyl-4-oxo-3H,4H-imidazo[4,3-d][1,2,3,5]tetrazine-8-carboxamide

CAS No.:

85623-02-5

Catalog Number:

AG01C5RD

Molecular Formula:

C12H10N6O2

Molecular Weight:

270.2468

Catalog Number:

AG01C5RD

Chemical Name:

3-benzyl-4-oxo-3H,4H-imidazo[4,3-d][1,2,3,5]tetrazine-8-carboxamide

CAS Number:

85623-02-5

Molecular Formula:

C12H10N6O2

Molecular Weight:

270.2468

MDL Number:

MFCD27938904

IUPAC Name:

3-benzyl-4-oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide

InChI:

InChI=1S/C12H10N6O2/c13-10(19)9-11-15-16-18(12(20)17(11)7-14-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,13,19)

InChI Key:

LNPSWLFCAODLDZ-UHFFFAOYSA-N

SMILES:

NC(=O)c1ncn2c1nnn(c2=O)Cc1ccccc1

Complexity:

434

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.087g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

270.252g/mol

Monoisotopic Mass:

270.087g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

106A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4