(E)-N-[2-(3-Indolyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)acrylamide - CAS 96014-22-1
Catalog: |
BB041934 |
Product Name: |
(E)-N-[2-(3-Indolyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)acrylamide |
CAS: |
96014-22-1 |
Synonyms: |
(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]-2-propenamide; (E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide |
IUPAC Name: | (E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide |
Description: | (E)-N-[2-(3-Indolyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)acrylamide (CAS# 96014-22-1 ) is a useful research chemical. |
Molecular Weight: | 336.38 |
Molecular Formula: | C20H20N2O3 |
Canonical SMILES: | COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=CC=CC=C32)O |
InChI: | InChI=1S/C20H20N2O3/c1-25-19-12-14(6-8-18(19)23)7-9-20(24)21-11-10-15-13-22-17-5-3-2-4-16(15)17/h2-9,12-13,22-23H,10-11H2,1H3,(H,21,24)/b9-7+ |
InChI Key: | LWRQDNUXWLIWDB-VQHVLOKHSA-N |
LogP: | 3.64510 |
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PMID | Publication Date | Title | Journal |
22568232 | 20120201 | [Chemical constituents of Datura stramonium seeds] | Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica |
19524439 | 20090801 | N-[(Dihydroxyphenyl)acyl]serotonins as potent inhibitors of tyrosinase from mouse and human melanoma cells | Bioorganic & medicinal chemistry letters |
19084396 | 20090115 | Synthesis and evaluation of a novel series of pseudo-cinnamic derivatives as antituberculosis agents | Bioorganic & medicinal chemistry letters |
19704837 | 20080901 | Induction of serotonin accumulation by feeding of rice striped stem borer in rice leaves | Plant signaling & behavior |
16366593 | 20051229 | Design, synthesis, and evaluation of pharmacological properties of cinnamic derivatives as antiatherogenic agents | Journal of medicinal chemistry |
Complexity: | 468 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 336.1473925 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 336.1473925 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 74.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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