Name: Name:1H-Pyrazole-4-carbonitrile, 3-amino-5-[(4-methoxyphenyl)amino]-
Brand: Angene
SKU: AG019ODG
Rating: 90 (10 reviews)

1H-Pyrazole-4-carbonitrile, 3-amino-5-[(4-methoxyphenyl)amino]-

CAS No.:

112606-39-0

Catalog Number:

AG019ODG

Molecular Formula:

C11H11N5O

Molecular Weight:

229.2379

Catalog Number:

AG019ODG

Chemical Name:

1H-Pyrazole-4-carbonitrile, 3-amino-5-[(4-methoxyphenyl)amino]-

CAS Number:

112606-39-0

Molecular Formula:

C11H11N5O

Molecular Weight:

229.2379

MDL Number:

MFCD04070825

IUPAC Name:

5-amino-3-(4-methoxyanilino)-1H-pyrazole-4-carbonitrile

InChI:

InChI=1S/C11H11N5O/c1-17-8-4-2-7(3-5-8)14-11-9(6-12)10(13)15-16-11/h2-5H,1H3,(H4,13,14,15,16)

InChI Key:

FLMZLZRMLJQFJA-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)Nc1n[nH]c(c1C#N)N

Complexity:

294

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

229.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

229.243g/mol

Monoisotopic Mass:

229.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

99.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: