Benzimidazole-4-carbonitrile - CAS 64574-21-6
Catalog: |
BB032506 |
Product Name: |
Benzimidazole-4-carbonitrile |
CAS: |
64574-21-6 |
Synonyms: |
1H-benzimidazole-4-carbonitrile; 1H-benzimidazole-4-carbonitrile |
IUPAC Name: | 1H-benzimidazole-4-carbonitrile |
Description: | Benzimidazole-4-carbonitrile (CAS# 64574-21-6) is a useful research chemical. |
Molecular Weight: | 143.15 |
Molecular Formula: | C8H5N3 |
Canonical SMILES: | C1=CC(=C2C(=C1)NC=N2)C#N |
InChI: | InChI=1S/C8H5N3/c9-4-6-2-1-3-7-8(6)11-5-10-7/h1-3,5H,(H,10,11) |
InChI Key: | LJYFETXSAWJLNA-UHFFFAOYSA-N |
MDL: | MFCD18204825 |
LogP: | 1.43458 |
Publication Number | Title | Priority Date |
WO-2021055591-A1 | Substituted benzimidazole carboxamides and their use in the treatment of medical disorders | 20190917 |
WO-2020210649-A1 | Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors | 20190412 |
WO-2019079578-A1 | BENZIMIDAZOLE DERIVATIVES AND USES THEREOF | 20171019 |
EP-3697410-A1 | Benzimidazole derivatives and their uses | 20171019 |
WO-2019049061-A1 | 5- (1H-BENZO [D] IMIDAZO-2-YL) -PYRIDIN-2-AMINE AND 5- (3H-IMIDAZO [4,5-B] PYRIDIN-6-YL) -PYRIDIN-2- DERIVATIVES AMINE AS HISTONE ACETYLTRANSFERASE INHIBITORS OF C-MYC AND P300 / CBP FOR THE TREATMENT OF CANCER | 20170907 |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 143.048347172 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 143.048347172 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 52.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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