5-Bromo-2-(hydroxymethyl)pyrimidine - CAS 22433-12-1
Catalog: |
BB017610 |
Product Name: |
5-Bromo-2-(hydroxymethyl)pyrimidine |
CAS: |
22433-12-1 |
Synonyms: |
(5-bromo-2-pyrimidinyl)methanol; (5-bromopyrimidin-2-yl)methanol |
IUPAC Name: | (5-bromopyrimidin-2-yl)methanol |
Description: | 5-Bromo-2-(hydroxymethyl)pyrimidine (CAS# 22433-12-1) is used to prepare alcohol-containing benzothiazoles as potent dual-targeting bacterial DNA supercoiling inhibitors. |
Molecular Weight: | 189.01 |
Molecular Formula: | C5H5BrN2O |
Canonical SMILES: | C1=C(C=NC(=N1)CO)Br |
InChI: | InChI=1S/C5H5BrN2O/c6-4-1-7-5(3-9)8-2-4/h1-2,9H,3H2 |
InChI Key: | ZRHVXSBXNUJBGF-UHFFFAOYSA-N |
LogP: | 0.73140 |
Publication Number | Title | Priority Date |
WO-2020109191-A1 | Aryl compounds for the treatment and prophylaxis of bacterial infection | 20181127 |
CN-113166144-A | Aryl compounds for the treatment and prevention of bacterial infections | 20181127 |
EP-3887371-A1 | Aryl compounds for the treatment and prophylaxis of bacterial infection | 20181127 |
US-2021309658-A1 | Aryl compounds for the treatment and prophylaxis of bacterial infection | 20181127 |
WO-2020041301-A1 | Pharmaceutical compounds for the treatment of complement factor d medical disorders | 20180820 |
Complexity: | 83 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.95853 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.95853 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 46 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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