Ethyl 4-(4-Fluorophenyl)-2-thiazolecarboxylate - CAS 886366-37-6
Catalog: |
BB039070 |
Product Name: |
Ethyl 4-(4-Fluorophenyl)-2-thiazolecarboxylate |
CAS: |
886366-37-6 |
Synonyms: |
4-(4-fluorophenyl)-2-thiazolecarboxylic acid ethyl ester; ethyl 4-(4-fluorophenyl)-1,3-thiazole-2-carboxylate |
IUPAC Name: | ethyl 4-(4-fluorophenyl)-1,3-thiazole-2-carboxylate |
Description: | Ethyl 4-(4-Fluorophenyl)-2-thiazolecarboxylate (CAS# 886366-37-6) is a useful research chemical. |
Molecular Weight: | 251.28 |
Molecular Formula: | C12H10FNO2S |
Canonical SMILES: | CCOC(=O)C1=NC(=CS1)C2=CC=C(C=C2)F |
InChI: | InChI=1S/C12H10FNO2S/c1-2-16-12(15)11-14-10(7-17-11)8-3-5-9(13)6-4-8/h3-7H,2H2,1H3 |
InChI Key: | GUUPIAOHATZXPK-UHFFFAOYSA-N |
LogP: | 3.12590 |
Publication Number | Title | Priority Date |
WO-2020035424-A1 | New heterocyclic compounds as monoacylglycerol lipase inhibitors | 20180813 |
WO-2020035425-A1 | New heterocyclic compounds as monoacylglycerol lipase inhibitors | 20180813 |
AU-2019322161-A1 | New heterocyclic compounds as monoacylglycerol lipase inhibitors | 20180813 |
CA-3098272-A1 | New heterocyclic compounds as monoacylglycerol lipase inhibitors | 20180813 |
TW-202021970-A | New heterocyclic compounds | 20180813 |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 251.0416279 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 251.0416279 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 67.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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