Methyl 1-Methylbenzimidazole-4-carboxylate - CAS 672957-91-4
Catalog: |
BB033239 |
Product Name: |
Methyl 1-Methylbenzimidazole-4-carboxylate |
CAS: |
672957-91-4 |
Synonyms: |
1-methyl-4-benzimidazolecarboxylic acid methyl ester; methyl 1-methylbenzimidazole-4-carboxylate |
IUPAC Name: | methyl 1-methylbenzimidazole-4-carboxylate |
Description: | Methyl 1-Methylbenzimidazole-4-carboxylate (CAS# 672957-91-4 ) is a useful research chemical. |
Molecular Weight: | 190.20 |
Molecular Formula: | C10H10N2O2 |
Canonical SMILES: | CN1C=NC2=C(C=CC=C21)C(=O)OC |
InChI: | InChI=1S/C10H10N2O2/c1-12-6-11-9-7(10(13)14-2)4-3-5-8(9)12/h3-6H,1-2H3 |
InChI Key: | SLJYGDIVZLZORW-UHFFFAOYSA-N |
LogP: | 1.35990 |
Publication Number | Title | Priority Date |
US-2019343812-A1 | Muscarinic m1 receptor positive allosteric modulators | 20160902 |
US-11040026-B2 | Muscarinic M1 receptor positive allosteric modulators | 20160902 |
EP-1670760-A1 | Organic compounds | 20031001 |
EP-1961752-A2 | Piperidine Compounds | 20031001 |
TW-200900399-A | Organic compounds | 20031001 |
Complexity: | 232 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 190.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 190.074227566 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 44.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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