1-Boc-5-bromo-6-methoxy-1H-indazole - CAS 1305320-56-2
Catalog: |
BB007119 |
Product Name: |
1-Boc-5-bromo-6-methoxy-1H-indazole |
CAS: |
1305320-56-2 |
Synonyms: |
5-bromo-6-methoxy-1-indazolecarboxylic acid tert-butyl ester; tert-butyl 5-bromo-6-methoxyindazole-1-carboxylate |
IUPAC Name: | tert-butyl 5-bromo-6-methoxyindazole-1-carboxylate |
Description: | 1-Boc-5-bromo-6-methoxy-1H-indazole (CAS# 1305320-56-2) is a useful research chemical. |
Molecular Weight: | 327.17 |
Molecular Formula: | C13H15BrN2O3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1C2=CC(=C(C=C2C=N1)Br)OC |
InChI: | InChI=1S/C13H15BrN2O3/c1-13(2,3)19-12(17)16-10-6-11(18-4)9(14)5-8(10)7-15-16/h5-7H,1-4H3 |
InChI Key: | VIQMSJUMBDMBQP-UHFFFAOYSA-N |
LogP: | 3.59060 |
Publication Number | Title | Priority Date |
AU-2016311425-A1 | Aryl, heteroaryl, and heterocyclic compounds for treatment of medical disorders | 20150826 |
EA-034781-B1 | Aryl, heteroaryl and heterocyclic compounds for the treatment of disorder mediated by complement factor D | 20150826 |
EP-3340981-A1 | Aryl, heteroaryl, and heterocyclic compounds for treatment of medical disorders | 20150826 |
JP-2018526367-A | Aryl, heteroaryl and heterocyclic compounds for the treatment of medical disorders | 20150826 |
KR-20180043343-A | Aryl, heteroaryl, and heterocyclic compounds for the treatment of medical disorders | 20150826 |
Complexity: | 345 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 326.0266 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 326.0266 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 53.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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