3-(2-Phenylhydrazono)-2-indolinone - CAS 17310-26-8
Catalog: |
BB012887 |
Product Name: |
3-(2-Phenylhydrazono)-2-indolinone |
CAS: |
17310-26-8 |
Synonyms: |
3-phenyldiazenyl-1H-indol-2-ol; 3-phenyldiazenyl-1H-indol-2-ol |
IUPAC Name: | 3-phenyldiazenyl-1H-indol-2-ol |
Description: | 3-(2-Phenylhydrazono)-2-indolinone (CAS# 17310-26-8 ) is a useful research chemical. |
Molecular Weight: | 237.26 |
Molecular Formula: | C14H11N3O |
Canonical SMILES: | C1=CC=C(C=C1)N=NC2=C(NC3=CC=CC=C32)O |
InChI: | InChI=1S/C14H11N3O/c18-14-13(11-8-4-5-9-12(11)15-14)17-16-10-6-2-1-3-7-10/h1-9,15,18H |
InChI Key: | QCBAMHXJXBGAQB-UHFFFAOYSA-N |
Boiling Point: | 363.2 °C at 760 mmHg |
Density: | 1.29 g/cm3 |
MDL: | MFCD00170813 |
LogP: | 2.66590 |
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 |
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PMID | Publication Date | Title | Journal |
21144622 | 20110101 | Synthesis and biophysical evaluation of arylhydrazono-1H-2-indolinones as β-amyloid aggregation inhibitors | European journal of medicinal chemistry |
17088067 | 20070115 | In vitro cytotoxicity evaluation of some substituted isatin derivatives | Bioorganic & medicinal chemistry |
15115396 | 20040506 | General model for estimation of the inhibition of protein kinases using Monte Carlo simulations | Journal of medicinal chemistry |
Complexity: | 301 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 237.090211983 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 237.090211983 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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