2-Amino-7-bromo-4-methoxy-1,3-benzothiazole - CAS 383865-53-0
Catalog: |
BB023653 |
Product Name: |
2-Amino-7-bromo-4-methoxy-1,3-benzothiazole |
CAS: |
383865-53-0 |
Synonyms: |
7-bromo-4-methoxy-1,3-benzothiazol-2-amine; 7-bromo-4-methoxy-1,3-benzothiazol-2-amine |
IUPAC Name: | 7-bromo-4-methoxy-1,3-benzothiazol-2-amine |
Description: | 2-Amino-7-bromo-4-methoxy-1,3-benzothiazole (CAS# 383865-53-0) is a useful research chemical. |
Molecular Weight: | 259.12 |
Molecular Formula: | C8H7BrN2OS |
Canonical SMILES: | COC1=C2C(=C(C=C1)Br)SC(=N2)N |
InChI: | InChI=1S/C8H7BrN2OS/c1-12-5-3-2-4(9)7-6(5)11-8(10)13-7/h2-3H,1H3,(H2,10,11) |
InChI Key: | FUTJCKPBRSQTAW-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
EP-3356330-A1 | Biaryl kinase inhibitors | 20151001 |
EP-3356330-B1 | Biaryl kinase inhibitors | 20151001 |
JP-2018529731-A | Biaryl kinase inhibitor | 20151001 |
KR-20180056764-A | Vialyl kinase inhibitor | 20151001 |
US-10246469-B2 | Biaryl kinase inhibitors | 20151001 |
Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.94625 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.94625 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 76.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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