5-Methoxy-2-(1H-pyrrol-1-yl)aniline - CAS 59194-26-2
Catalog: |
BB030296 |
Product Name: |
5-Methoxy-2-(1H-pyrrol-1-yl)aniline |
CAS: |
59194-26-2 |
Synonyms: |
5-methoxy-2-(1-pyrrolyl)aniline; 5-methoxy-2-pyrrol-1-ylaniline |
IUPAC Name: | 5-methoxy-2-pyrrol-1-ylaniline |
Description: | 5-Methoxy-2-(1H-pyrrol-1-yl)aniline (CAS# 59194-26-2) is a useful research chemical. |
Molecular Weight: | 188.23 |
Molecular Formula: | C11H12N2O |
Canonical SMILES: | COC1=CC(=C(C=C1)N2C=CC=C2)N |
InChI: | InChI=1S/C11H12N2O/c1-14-9-4-5-11(10(12)8-9)13-6-2-3-7-13/h2-8H,12H2,1H3 |
InChI Key: | LKSVZBCORDEARF-UHFFFAOYSA-N |
Boiling Point: | 345.3 °C at 760 mmHg |
Density: | 1.13 g/cm3 |
MDL: | MFCD00047063 |
LogP: | 2.64930 |
Publication Number | Title | Priority Date |
WO-2021147699-A1 | Pyridoheterocyclic compound, and preparation method therefor and use thereof | 20200121 |
US-2019083491-A1 | Small molecules inhibitors of rad51 | 20160302 |
WO-2017149493-A1 | Small molecules inhibitors of rad51 | 20160302 |
US-10973819-B2 | Small molecules inhibitors of RAD51 | 20160302 |
WO-2015004304-A1 | Salts of pyridazino[2,3-a]pyrrolo[2,1-c]quinoxaline for the treatment of leishmania infections and diseases that involve the protein tyrosine phosphatase 1b | 20130710 |
Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.094963011 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 40.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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Amines and Anilines
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