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1010871-55-2 | N-[2-(1H-Indol-3-yl)ethyl]-4-methyl-7-[(2-methyl-2-propen-1-yl)oxy]-2-oxo-2H-1-benzopyran-6-propanamide
CAS No: 1010871-55-2 Catalog No: AG01DZBX MDL No:
Product Description
Catalog Number:
AG01DZBX
Chemical Name:
N-[2-(1H-Indol-3-yl)ethyl]-4-methyl-7-[(2-methyl-2-propen-1-yl)oxy]-2-oxo-2H-1-benzopyran-6-propanamide
CAS Number:
1010871-55-2
IUPAC Name:
N-[2-(1H-indol-3-yl)ethyl]-3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxochromen-6-yl]propanamide
InChI:
InChI=1S/C27H28N2O4/c1-17(2)16-32-24-14-25-22(18(3)12-27(31)33-25)13-19(24)8-9-26(30)28-11-10-20-15-29-23-7-5-4-6-21(20)23/h4-7,12-15,29H,1,8-11,16H2,2-3H3,(H,28,30)
InChI Key:
PQTVOXMVZGRASB-UHFFFAOYSA-N
Properties
Complexity:
763
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
444.205g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
444.531g/mol
Monoisotopic Mass:
444.205g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
80.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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