Name: Name:3-[(3-amino-1H-pyrazol-1-yl)sulfonyl]benzonitrile
Brand: Angene
SKU: AG01AHZT
Rating: 90 (10 reviews)

3-[(3-amino-1H-pyrazol-1-yl)sulfonyl]benzonitrile

CAS No.:

1306603-34-8

Catalog Number:

AG01AHZT

Molecular Formula:

C10H8N4O2S

Molecular Weight:

248.2611

Catalog Number:

AG01AHZT

Chemical Name:

3-[(3-amino-1H-pyrazol-1-yl)sulfonyl]benzonitrile

CAS Number:

1306603-34-8

Molecular Formula:

C10H8N4O2S

Molecular Weight:

248.2611

MDL Number:

MFCD18838774

IUPAC Name:

3-(3-aminopyrazol-1-yl)sulfonylbenzonitrile

InChI:

InChI=1S/C10H8N4O2S/c11-7-8-2-1-3-9(6-8)17(15,16)14-5-4-10(12)13-14/h1-6H,(H2,12,13)

InChI Key:

KTIWRUCGDRFTOG-UHFFFAOYSA-N

SMILES:

N#Cc1cccc(c1)S(=O)(=O)n1ccc(n1)N

Complexity:

421

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

248.037g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.26g/mol

Monoisotopic Mass:

248.037g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

110A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8