Pazopanib hydrochloride

C₂₁H₂₄ClN₇O₂SCAS 635702-64-6473.98 g/mol

Open in Covalent MOL file

Secondary amine Sulfonamide Tertiary amine

Properties

Molecular formula: C₂₁H₂₄ClN₇O₂S
Molar mass: 473.98 g/mol
Exact mass: 473.1401 Da
logP: 3.56Crippen estimate
Polar surface area: 119.0 Å²
H-bond donors / acceptors: 2 / 7
Rotatable bonds: 5

Hazards

Danger

H351 Suspected of causing cancer16.7% of notifiers
H360 May damage fertility or the unborn child16.7% of notifiers
H361 Suspected of damaging fertility or the unborn child66.7% of notifiers
H361fd Suspected of damaging fertility; Suspected of damaging the unborn child16.7% of notifiers
H372 Causes damage to organs through prolonged or repeated exposure66.7% of notifiers
H400 Very toxic to aquatic life33.3% of notifiers
H411 Toxic to aquatic life with long lasting effects66.7% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P264, P270, P273, P280, P318, P319, P391, P405, P501

Identifiers

CAS number

635702-64-6

SMILES

Cc1ccc(Nc2nccc(N(C)c3ccc4c(C)n(C)nc4c3)n2)cc1S(N)(=O)=O.Cl

InChIKey

MQHIQUBXFFAOMK-UHFFFAOYSA-N

InChI

InChI=1S/C21H23N7O2S.ClH/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);1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names

Benzenesulfonamide, 5-[[4-[(2,3-dimethyl-2H-indazol-6-yl)methylamino]-2-pyrimidinyl]amino]-2-methyl-, hydrochloride (1:1)
Benzenesulfonamide, 5-[[4-[(2,3-dimethyl-2H-indazol-6-yl)methylamino]-2-pyrimidinyl]amino]-2-methyl-, monohydrochloride
GW 786034B
5-[[4-[(2,3-Dimethyl-2H-indazol-6-yl)(methyl)amino]pyrimidin-2-yl]amino]-2-methylbenzenesulfonamide hydrochloride

Work with Pazopanib hydrochloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Pazopanib444731-52-6Free base

Similar compounds

N-(2-Chloro-4-pyrimidinyl)-N,2,3-trimethyl-2H-indazol-6-amine444731-75-353 % similar 2,3-Dimethyl-2H-indazol-6-amine hydrochloride635702-60-236 % similar 2,3-Dimethyl-2H-indazol-6-amine444731-72-032 % similar N-(2-Chloro-4-pyrimidinyl)-2,3-dimethyl-2H-indazol-6-amine444731-74-231 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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