Name: Name:3-Hydroxy-4-[(E)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazen-1-yl]-N,N-dimethylnaphthalene-1-sulfonamide
Brand: Angene
SKU: AG01F2IU
Rating: 90 (10 reviews)

3-Hydroxy-4-[(E)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazen-1-yl]-N,N-dimethylnaphthalene-1-sulfonamide

CAS No.:

1211938-40-7

Catalog Number:

AG01F2IU

Molecular Formula:

C22H21N5O4S

Molecular Weight:

451.4982

Catalog Number:

AG01F2IU

Chemical Name:

3-Hydroxy-4-[(E)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazen-1-yl]-N,N-dimethylnaphthalene-1-sulfonamide

CAS Number:

1211938-40-7

Molecular Formula:

C22H21N5O4S

Molecular Weight:

451.4982

MDL Number:

MFCD00962909

IUPAC Name:

3-hydroxy-N,N-dimethyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]naphthalene-1-sulfonamide

InChI:

InChI=1S/C22H21N5O4S/c1-14-20(22(29)27(25-14)15-9-5-4-6-10-15)23-24-21-17-12-8-7-11-16(17)19(13-18(21)28)32(30,31)26(2)3/h4-13,25,28H,1-3H3

InChI Key:

CHDCCKRZZZOHDL-UHFFFAOYSA-N

SMILES:

Cc1nn(c(c1/N=N/c1c(O)cc(c2c1cccc2)S(=O)(=O)N(C)C)O)c1ccccc1

Complexity:

875

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

451.131g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

451.501g/mol

Monoisotopic Mass:

451.131g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

123A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9