2-oxo-2,3-dihydro-1H-benzo[d]imidazole-5-carbaldehyde - CAS 106429-59-8
Catalog: |
BB001868 |
Product Name: |
2-oxo-2,3-dihydro-1H-benzo[d]imidazole-5-carbaldehyde |
CAS: |
106429-59-8 |
Synonyms: |
2-oxo-1,3-dihydrobenzimidazole-5-carboxaldehyde; 2-oxo-1,3-dihydrobenzimidazole-5-carbaldehyde |
IUPAC Name: | 2-oxo-1,3-dihydrobenzimidazole-5-carbaldehyde |
Description: | 2-Oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carbaldehyde can be prepared as inhibitors of nucleases useful in treatment and prophylaxis of diseases. |
Molecular Weight: | 162.15 |
Molecular Formula: | C8H6N2O2 |
Canonical SMILES: | C1=CC2=C(C=C1C=O)NC(=O)N2 |
InChI: | InChI=1S/C8H6N2O2/c11-4-5-1-2-6-7(3-5)10-8(12)9-6/h1-4H,(H2,9,10,12) |
InChI Key: | JHQJXBRTXLUDIM-UHFFFAOYSA-N |
Storage: | Sealed in dry, Room Temperature |
LogP: | 1.08100 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3556755-A1 | Substituted aminothiazoles as inhibitors of nucleases | 20180417 |
WO-2019201865-A1 | Substituted aminothiazoles as inhibitors of nucleases | 20180417 |
AU-2018389145-A1 | Exo-aza spiro inhibitors of menin-MLL interaction | 20171220 |
WO-2019120209-A1 | Exo-aza spiro inhibitors of menin-mll interaction | 20171220 |
CA-3083624-A1 | Exo-aza spiro inhibitors of menin-mll interaction | 20171220 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.042927438 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.042927438 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 58.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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Related Functional Groups
Benzimidazoles
Carbonyl Compounds
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