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945453-47-4 | (E)-N-[2-(3-Indolyl)ethyl]-3-(3,4-dihydroxyphenyl)acrylamide
CAS No: 945453-47-4 Catalog No: AG00IIBS MDL No:MFCD30537122
Product Description
Catalog Number:
AG00IIBS
Chemical Name:
(E)-N-[2-(3-Indolyl)ethyl]-3-(3,4-dihydroxyphenyl)acrylamide
CAS Number:
945453-47-4
Molecular Formula:
C19H18N2O3
Molecular Weight:
322.3578
MDL Number:
MFCD30537122
IUPAC Name:
(E)-3-(3,4-dihydroxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
InChI:
InChI=1S/C19H18N2O3/c22-17-7-5-13(11-18(17)23)6-8-19(24)20-10-9-14-12-21-16-4-2-1-3-15(14)16/h1-8,11-12,21-23H,9-10H2,(H,20,24)/b8-6+
InChI Key:
LNKPAQNDSCOUPS-SOFGYWHQSA-N
SMILES:
O=C(/C=C/c1ccc(c(c1)O)O)NCCc1c[nH]c2c1cccc2
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
322.132g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
322.364g/mol
Monoisotopic Mass:
322.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
85.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Safflomide increases the expression of adiponectin in vitro and in vivo: potential implication for hypoadiponectemia, visceral obesity, and insulin resistance. | Journal of agricultural and food chemistry 20120425 |
| Synthesis, biological evaluation, and structure-activity relationship study of novel cytotoxic aza-caffeic acid derivatives. | Bioorganic & medicinal chemistry 20100901 |
| N-[(Dihydroxyphenyl)acyl]serotonins as potent inhibitors of tyrosinase from mouse and human melanoma cells. | Bioorganic & medicinal chemistry letters 20090801 |
| Serotomide and safflomide modulate forskolin-stimulated cAMP formation via 5-HT1 receptor. | Phytomedicine : international journal of phytotherapy and phytopharmacology 20081201 |
| Synthesis of safflomide and its HPLC measurement in mouse plasma after oral administration. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20070601 |
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