Name: Name:5-(3-aminophenyl)-1H,2H,3H,4H,7H,8H,9H-pyridazino[4,5-a]pyrrolizine-1,4-dione
Brand: Angene
SKU: AG019UF9
Rating: 90 (10 reviews)

5-(3-aminophenyl)-1H,2H,3H,4H,7H,8H,9H-pyridazino[4,5-a]pyrrolizine-1,4-dione

CAS No.:

1114822-85-3

Catalog Number:

AG019UF9

Molecular Formula:

C15H14N4O2

Molecular Weight:

282.2973

Catalog Number:

AG019UF9

Chemical Name:

5-(3-aminophenyl)-1H,2H,3H,4H,7H,8H,9H-pyridazino[4,5-a]pyrrolizine-1,4-dione

CAS Number:

1114822-85-3

Molecular Formula:

C15H14N4O2

Molecular Weight:

282.2973

MDL Number:

MFCD11838894

IUPAC Name:

5-(3-aminophenyl)-3,7,8,9-tetrahydro-2H-pyridazino[4,5-a]pyrrolizine-1,4-dione

InChI:

InChI=1S/C15H14N4O2/c16-9-4-1-3-8(7-9)13-12-11(10-5-2-6-19(10)13)14(20)17-18-15(12)21/h1,3-4,7H,2,5-6,16H2,(H,17,20)(H,18,21)

InChI Key:

RUWIMHQTUUVVRD-UHFFFAOYSA-N

SMILES:

Nc1cccc(c1)c1c2c(=O)[nH][nH]c(=O)c2c2n1CCC2

Complexity:

469

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

282.112g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.303g/mol

Monoisotopic Mass:

282.112g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

89.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5