4-Chloro-2-(methylsulfonyl)pyrimidine - CAS 97229-11-3
Catalog: |
BB042041 |
Product Name: |
4-Chloro-2-(methylsulfonyl)pyrimidine |
CAS: |
97229-11-3 |
Synonyms: |
4-chloro-2-methylsulfonylpyrimidine; 4-chloro-2-methylsulfonylpyrimidine |
IUPAC Name: | 4-chloro-2-methylsulfonylpyrimidine |
Description: | 4-Chloro-2-(methylsulfonyl)pyrimidine (CAS# 97229-11-3) is a useful research chemical. |
Molecular Weight: | 192.62 |
Molecular Formula: | C5H5ClN2O2S |
Canonical SMILES: | CS(=O)(=O)C1=NC=CC(=N1)Cl |
InChI: | InChI=1S/C5H5ClN2O2S/c1-11(9,10)5-7-3-2-4(6)8-5/h2-3H,1H3 |
InChI Key: | BWVZLXTZQHILRC-UHFFFAOYSA-N |
Boiling Point: | 371.2 ℃ at 760 mmHg |
Density: | 1.486 g/cm3 |
Storage: | Inert atmosphere, 2-8 ℃ |
LogP: | 1.61430 |
Publication Number | Title | Priority Date |
WO-2021081207-A1 | Glp-1r modulating compounds | 20191025 |
US-2021171499-A1 | Glp-1r modulating compounds | 20191025 |
WO-2021064677-A1 | Inhibitors of human immunodeficiency virus replication | 20191004 |
US-2021094943-A1 | Heterocyclic compounds | 20190912 |
US-2020377474-A1 | Therapeutic compounds and methods of use thereof | 20190603 |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.9760263 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.9760263 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 68.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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