5-Phenylpyrimidine-2-carboxylic Acid - CAS 85386-20-5
Catalog: |
BB037606 |
Product Name: |
5-Phenylpyrimidine-2-carboxylic Acid |
CAS: |
85386-20-5 |
Synonyms: |
5-phenyl-2-pyrimidinecarboxylic acid; 5-phenylpyrimidine-2-carboxylic acid |
IUPAC Name: | 5-phenylpyrimidine-2-carboxylic acid |
Description: | 5-Phenylpyrimidine-2-carboxylic Acid (CAS# 85386-20-5) is a useful research chemical. |
Molecular Weight: | 200.19 |
Molecular Formula: | C11H8N2O2 |
Canonical SMILES: | C1=CC=C(C=C1)C2=CN=C(N=C2)C(=O)O |
InChI: | InChI=1S/C11H8N2O2/c14-11(15)10-12-6-9(7-13-10)8-4-2-1-3-5-8/h1-7H,(H,14,15) |
InChI Key: | ZONDVYAPHBZSJV-UHFFFAOYSA-N |
LogP: | 1.84180 |
Publication Number | Title | Priority Date |
AU-2016240033-A1 | 1-cyano-pyrrolidine compounds as USP30 inhibitors | 20150330 |
AU-2016240033-B2 | 1-cyano-pyrrolidine compounds as USP30 inhibitors | 20150330 |
CA-2976741-A1 | 1-cyano-pyrrolidine compounds as usp30 inhibitors | 20150330 |
CN-107484415-A | 1 cyanopyrrolidine compound as USP30 inhibitor | 20150330 |
EP-3277677-A1 | 1-cyano-pyrrolidine compounds as usp30 inhibitors | 20150330 |
Complexity: | 219 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.058577502 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 63.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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