Home Other Building Blocks 3-[2-(2,4-dimethoxyphenyl)-1H-indol-3-yl]propanoic acid

3-[2-(2,4-dimethoxyphenyl)-1H-indol-3-yl]propanoic acid

CAS No.:
926259-58-7
Catalog Number:
AG019XCY
Molecular Formula:
C19H19NO4
Molecular Weight:
325.3585
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Product Description
Catalog Number:
AG019XCY
Chemical Name:
3-[2-(2,4-dimethoxyphenyl)-1H-indol-3-yl]propanoic acid
CAS Number:
926259-58-7
Molecular Formula:
C19H19NO4
Molecular Weight:
325.3585
MDL Number:
MFCD09040962
IUPAC Name:
3-[2-(2,4-dimethoxyphenyl)-1H-indol-3-yl]propanoic acid
InChI:
InChI=1S/C19H19NO4/c1-23-12-7-8-15(17(11-12)24-2)19-14(9-10-18(21)22)13-5-3-4-6-16(13)20-19/h3-8,11,20H,9-10H2,1-2H3,(H,21,22)
InChI Key:
WEVWBIJISCZDAJ-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OC)c1[nH]c2c(c1CCC(=O)O)cccc2
Properties
Complexity:
430  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.131g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
325.364g/mol
Monoisotopic Mass:
325.131g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties