Name: Name:3-[(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)methyl]-1-methyl-1H-pyrazole-4-carbaldehyde
Brand: Angene
SKU: AG01B6O0
Rating: 90 (10 reviews)

3-[(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)methyl]-1-methyl-1H-pyrazole-4-carbaldehyde

CAS No.:

1420794-02-0

Catalog Number:

AG01B6O0

Molecular Formula:

C14H11N3O3

Molecular Weight:

269.2554

Catalog Number:

AG01B6O0

Chemical Name:

3-[(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)methyl]-1-methyl-1H-pyrazole-4-carbaldehyde

CAS Number:

1420794-02-0

Molecular Formula:

C14H11N3O3

Molecular Weight:

269.2554

MDL Number:

MFCD22689076

IUPAC Name:

3-[(1,3-dioxoisoindol-2-yl)methyl]-1-methylpyrazole-4-carbaldehyde

InChI:

InChI=1S/C14H11N3O3/c1-16-6-9(8-18)12(15-16)7-17-13(19)10-4-2-3-5-11(10)14(17)20/h2-6,8H,7H2,1H3

InChI Key:

NOTNKDBESXETSE-UHFFFAOYSA-N

SMILES:

O=Cc1cn(nc1CN1C(=O)c2c(C1=O)cccc2)C

Complexity:

415

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.26g/mol

Monoisotopic Mass:

269.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2