2-Amino-4-[4-(methylsulfonyl)phenyl]thiazole - CAS 383131-95-1
Catalog: |
BB023629 |
Product Name: |
2-Amino-4-[4-(methylsulfonyl)phenyl]thiazole |
CAS: |
383131-95-1 |
Synonyms: |
4-(4-methylsulfonylphenyl)-2-thiazolamine; 4-(4-methylsulfonylphenyl)-1,3-thiazol-2-amine |
IUPAC Name: | 4-(4-methylsulfonylphenyl)-1,3-thiazol-2-amine |
Description: | 2-Amino-4-[4-(methylsulfonyl)phenyl]thiazole (CAS# 383131-95-1) is a useful research chemical, an intermediate for the preparation of functionalized aminothiazoles. |
Molecular Weight: | 254.33 |
Molecular Formula: | C10H10N2O2S2 |
Canonical SMILES: | CS(=O)(=O)C1=CC=C(C=C1)C2=CSC(=N2)N |
InChI: | InChI=1S/C10H10N2O2S2/c1-16(13,14)8-4-2-7(3-5-8)9-6-15-10(11)12-9/h2-6H,1H3,(H2,11,12) |
InChI Key: | VQEMDSRIOVZAOM-UHFFFAOYSA-N |
MDL: | MFCD02663888 |
LogP: | 3.45780 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation] |
Precautionary Statement: | P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-110845437-A | Method for preparing 2-aminothiazole compound | 20191113 |
EP-3556755-A1 | Substituted aminothiazoles as inhibitors of nucleases | 20180417 |
WO-2019201865-A1 | Substituted aminothiazoles as inhibitors of nucleases | 20180417 |
AU-2019256670-A1 | Substituted aminothiazoles as inhibitors of nucleases | 20180417 |
IL-277866-D0 | Aminothiazoles have been replaced as nucleating inhibitors | 20180417 |
Complexity: | 331 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 254.01836991 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 254.01836991 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 110 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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