4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide

C24H20N6O2S — CID 24865656

IUPAC4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(Nc3ccn4ncc(-c5ccncc5)c4n3)cc2)cc1
InChIInChI=1S/C24H20N6O2S/c1-17-2-8-21(9-3-17)33(31,32)29-20-6-4-19(5-7-20)27-23-12-15-30-24(28-23)22(16-26-30)18-10-13-25-14-11-18/h2-16,29H,1H3,(H,27,28)
InChIKeySOXBFGYRJIWTPY-UHFFFAOYSA-N
MW456.53 g/mol
LogP4.64
Rot. Bonds6

About 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide

4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide (PubChem CID 24865656) has the molecular formula C24H20N6O2S and a molecular weight of 456.53 g/mol. Its IUPAC name is 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide
PubChem CID24865656
Molecular FormulaC24H20N6O2S
Molecular Weight456.53 g/mol
Exact Mass456.14
IUPAC Name4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(Nc3ccn4ncc(-c5ccncc5)c4n3)cc2)cc1
InChIInChI=1S/C24H20N6O2S/c1-17-2-8-21(9-3-17)33(31,32)29-20-6-4-19(5-7-20)27-23-12-15-30-24(28-23)22(16-26-30)18-10-13-25-14-11-18/h2-16,29H,1H3,(H,27,28)
InChIKeySOXBFGYRJIWTPY-UHFFFAOYSA-N
XLogP4.64
TPSA101.28 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.53
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[[3-[4-[4-(dimethylamino)-2-methylidenebutanoyl]cyclohexa-1,5-dien-1-yl]pyrazolo[1,5-a]pyrimidin-5-yl]amino]phenyl]-4-methylbenzenesulfonamide
CID 89315200
4-methyl-N-[4-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]phenyl]benzenesulfonamide
CID 110504080
N-[5-[[3-(3-iodophenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-methylphenyl]methanesulfonamide
CID 71129784
N-(4-methylphenyl)-4-[4-[(4-methylphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 4994558
N-[4-[(6-imidazol-1-ylpyrimidin-4-yl)amino]phenyl]-4-methylbenzenesulfonamide
CID 121074106
N-[5-[[3-(3-aminophenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-methylphenyl]methanesulfonamide
CID 59662332
4-methyl-N-[4-[[2-methyl-6-[(4-methyl-2-pyridinyl)amino]pyrimidin-4-yl]amino]phenyl]benzenesulfonamide
CID 122316681
N-(5-methyl-2-pyridinyl)-4-pyridin-4-ylbenzenesulfonamide
CID 110454365
4-methoxy-N-[4-(4-methyl-3-pyridinyl)phenyl]benzenesulfonamide
CID 66714466
4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol
CID 24864574
4-methyl-N-(3-pyridin-4-ylphenyl)benzenesulfonamide
CID 169371905
4-chloro-N-[6-(4-methylanilino)pyridazin-3-yl]benzenesulfonamide
CID 113045875

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide?
The IUPAC name of 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide (CID 24865656) is 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide?
The canonical SMILES for 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide is Cc1ccc(S(=O)(=O)Nc2ccc(Nc3ccn4ncc(-c5ccncc5)c4n3)cc2)cc1.
What is the InChIKey of 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide?
The InChIKey is SOXBFGYRJIWTPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N6O2S/c1-17-2-8-21(9-3-17)33(31,32)29-20-6-4-19(5-7-20)27-23-12-15-30-24(28-23)22(16-26-30)18-10-13-25-14-11-18/h2-16,29H,1H3,(H,27,28).
What are the key properties of 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide?
4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide has a molecular weight of 456.53 g/mol, XLogP of 4.64, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[4-[(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)amino]phenyl]benzenesulfonamide is sourced from PubChem (CID 24865656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).