N1-(6-Indazolyl)sulfanilamide - CAS 13744-68-8
Catalog: |
BB008568 |
Product Name: |
N1-(6-Indazolyl)sulfanilamide |
CAS: |
13744-68-8 |
Synonyms: |
4-amino-N-(1H-indazol-6-yl)benzenesulfonamide |
IUPAC Name: | 4-amino-N-(1H-indazol-6-yl)benzenesulfonamide |
Description: | N1-(6-Indazolyl)sulfanilamide (CAS# 13744-68-8 ) is a useful research chemical. |
Molecular Weight: | 288.32 |
Molecular Formula: | C13H12N4O2S |
Canonical SMILES: | C1=CC(=CC=C1N)S(=O)(=O)NC2=CC3=C(C=C2)C=NN3 |
InChI: | InChI=1S/C13H12N4O2S/c14-10-2-5-12(6-3-10)20(18,19)17-11-4-1-9-8-15-16-13(9)7-11/h1-8,17H,14H2,(H,15,16) |
InChI Key: | RLNLIVBLEZDLMZ-UHFFFAOYSA-N |
Boiling Point: | 581.1 °C at 760 mmHg |
Density: | 1.546 g/cm3 |
MDL: | MFCD00005694 |
LogP: | 3.68090 |
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 |
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PMID | Publication Date | Title | Journal |
11962748 | 20020401 | Recovery process of arthritis induced by 6-sulfanilamidoindazole (6SAI) in rats | Histology and histopathology |
11926286 | 20020201 | Role of endotoxin in 6-sulfanilamidoindazole(6SAI)-induced arthritis in rats | Experimental and toxicologic pathology : official journal of the Gesellschaft fur Toxikologische Pathologie |
Complexity: | 428 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 288.06809681 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 288.06809681 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 109 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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