5-Amino-2-methylbenzenesulfonamide - CAS 6973-09-7
Catalog: |
BB033952 |
Product Name: |
5-Amino-2-methylbenzenesulfonamide |
CAS: |
6973-09-7 |
Synonyms: |
5-amino-2-methylbenzenesulfonamide; 5-amino-2-methylbenzenesulfonamide |
IUPAC Name: | 5-amino-2-methylbenzenesulfonamide |
Description: | 5-Amino-2-methylbenzenesulfonamide (CAS# 6973-09-7) is an intermediate for the synthesis of Pazopanib (P210925), an oral angiogenesis inhibitor targeting VEGFR and PDGFR. |
Molecular Weight: | 186.23 |
Molecular Formula: | C7H10N2O2S |
Canonical SMILES: | CC1=C(C=C(C=C1)N)S(=O)(=O)N |
InChI: | InChI=1S/C7H10N2O2S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,8H2,1H3,(H2,9,10,11) |
InChI Key: | KTPBKMYOIFHJMI-UHFFFAOYSA-N |
Boiling Point: | 421.5 °C at 760 mmHg |
Density: | 1.359 g/cm3 |
MDL: | MFCD06681071 |
LogP: | 2.58690 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021162647-A1 | A novel process for preparation of pazopanib hydrochloride | 20200210 |
CN-112538073-A | Preparation method of pazopanib intermediate | 20190923 |
WO-2021026451-A1 | Compounds and method for treating cytokine release syndrome | 20190808 |
CN-109535044-B | Diazotization method of aromatic primary amine | 20181218 |
CN-111196804-A | TGF- β R1 inhibitor and application thereof | 20181120 |
PMID | Publication Date | Title | Journal |
28665493 | 20171001 | Assessment of the inhibitory effects and molecular docking of some sulfonamides on human serum paraoxonase 1 | Journal of biochemical and molecular toxicology |
21583518 | 20090711 | 5-Amino-2-methyl-benzene-sulfonamide | Acta crystallographica. Section E, Structure reports online |
Complexity: | 245 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.04629874 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.04629874 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 94.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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