Name: Name:1H-Pyrrolo[1,2-a]imidazole-6-carbonitrile,2,3-dihydro-3-methyl-2-oxo-(9CI)
Brand: Angene
SKU: AG00EY1D
Rating: 90 (10 reviews)

1H-Pyrrolo[1,2-a]imidazole-6-carbonitrile,2,3-dihydro-3-methyl-2-oxo-(9CI)

CAS No.:

565453-80-7

Catalog Number:

AG00EY1D

Molecular Formula:

C8H7N3O

Molecular Weight:

161.1607

Catalog Number:

AG00EY1D

Chemical Name:

1H-Pyrrolo[1,2-a]imidazole-6-carbonitrile,2,3-dihydro-3-methyl-2-oxo-(9CI)

CAS Number:

565453-80-7

Molecular Formula:

C8H7N3O

Molecular Weight:

161.1607

MDL Number:

MFCD12924545

IUPAC Name:

3-methyl-2-oxo-1,3-dihydropyrrolo[1,2-a]imidazole-6-carbonitrile

InChI:

InChI=1S/C8H7N3O/c1-5-8(12)10-7-2-6(3-9)4-11(5)7/h2,4-5H,1H3,(H,10,12)

InChI Key:

REDXEZJAVOEZAO-UHFFFAOYSA-N

SMILES:

N#Cc1cn2c(c1)NC(=O)C2C

Complexity:

267

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

161.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

161.164g/mol

Monoisotopic Mass:

161.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2