Name: Name:2-chloro-N-(4-cyano-1-phenyl-1H-pyrazol-5-yl)acetamide
Brand: Angene
SKU: AG019VLG
Rating: 90 (10 reviews)

2-chloro-N-(4-cyano-1-phenyl-1H-pyrazol-5-yl)acetamide

CAS No.:

397860-10-5

Catalog Number:

AG019VLG

Molecular Formula:

C12H9ClN4O

Molecular Weight:

260.6791

Catalog Number:

AG019VLG

Chemical Name:

2-chloro-N-(4-cyano-1-phenyl-1H-pyrazol-5-yl)acetamide

CAS Number:

397860-10-5

Molecular Formula:

C12H9ClN4O

Molecular Weight:

260.6791

MDL Number:

MFCD01989752

IUPAC Name:

2-chloro-N-(4-cyano-2-phenylpyrazol-3-yl)acetamide

InChI:

InChI=1S/C12H9ClN4O/c13-6-11(18)16-12-9(7-14)8-15-17(12)10-4-2-1-3-5-10/h1-5,8H,6H2,(H,16,18)

InChI Key:

BDMOFSSKCYDHFR-UHFFFAOYSA-N

SMILES:

ClCC(=O)Nc1c(C#N)cnn1c1ccccc1

Complexity:

347

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

260.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

260.681g/mol

Monoisotopic Mass:

260.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3