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pazopanib

pazopanib

CAS: 444731-52-6

Formula: C21H23N7O2S

SMILES: CN(C1=CC2=NN(C)C(C)=C2C=C1)C1=CC=NC(NC2=CC=C(C)C(=C2)S(N)(=O)=O)=N1

IUPAC: 5-({4-[(2,3-dimethyl-2H-indazol-6-yl)(methyl)amino]pyrimidin-2-yl}amino)-2-methylbenzene-1-sulfonamide

InChI: InChI=1S/C21H23N7O2S/c1-13-5-6-15(11-19(13)31(22,29)30)24-21-23-10-9-20(25-21)27(3)16-7-8-17-14(2)28(4)26-18(17)12-16/h5-12H,1-4H3,(H2,22,29,30)(H,23,24,25)

Composition: C (57.65%), H (5.30%), N (22.41%), O (7.31%), S (7.33%)

Molar Mass: 437.52

Atom Count: 54

Heavy Atom Count: 31

Properties
Properties
Common Names pazopanib
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 437.163394183
Formal Charge 0
FSP3 0.19
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 2
InChIKey CUIHSIWYWATEQL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 132.18
Topological Polar Surface Area 119.03
Polarizability 46.7
Ring Count 4
Rotatable Bond Count 5

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99% <10 Days 444731-52-6 Quote Only