4-(1-Methyl-5-imidazolyl)benzoic Acid - CAS 305806-38-6
Catalog: |
BB020647 |
Product Name: |
4-(1-Methyl-5-imidazolyl)benzoic Acid |
CAS: |
305806-38-6 |
Synonyms: |
4-(3-methyl-4-imidazolyl)benzoic acid; 4-(3-methylimidazol-4-yl)benzoic acid |
IUPAC Name: | 4-(3-methylimidazol-4-yl)benzoic acid |
Description: | 4-(1-Methyl-5-imidazolyl)benzoic Acid (CAS# 305806-38-6) is a useful research chemical. |
Molecular Weight: | 202.21 |
Molecular Formula: | C11H10N2O2 |
Canonical SMILES: | CN1C=NC=C1C2=CC=C(C=C2)C(=O)O |
InChI: | InChI=1S/C11H10N2O2/c1-13-7-12-6-10(13)8-2-4-9(5-3-8)11(14)15/h2-7H,1H3,(H,14,15) |
InChI Key: | VRUJRMUIEJAVSP-UHFFFAOYSA-N |
LogP: | 1.78530 |
Publication Number | Title | Priority Date |
EP-2892888-A1 | N-cyclopropyl-n-piperidinyl-amides, pharmaceutical compositions containing them, and uses thereof | 20120910 |
EP-2892888-B1 | N-cyclopropyl-n-piperidinyl-amides, pharmaceutical compositions containing them, and uses thereof | 20120910 |
JP-2015527379-A | N-cyclopropyl-N-piperidinyl-amide, pharmaceutical compositions containing them and uses thereof | 20120910 |
JP-6263789-B2 | N-cyclopropyl-N-piperidinyl-amide, pharmaceutical compositions containing them and uses thereof | 20120910 |
US-2015225390-A1 | N-cyclopropyl-n-piperidinyl-amides, pharmaceutical compositions containing them, and uses thereof | 20120910 |
Complexity: | 237 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.074227566 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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