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102433-28-3 | Urea, N-[4,7-dimethoxy-6-[2-(1-pyrrolidinyl)propoxy]-5-benzofuranyl]-N'-methyl-
CAS No: 102433-28-3 Catalog No: AG0007GV MDL No:
Product Description
Catalog Number:
AG0007GV
Chemical Name:
Urea, N-[4,7-dimethoxy-6-[2-(1-pyrrolidinyl)propoxy]-5-benzofuranyl]-N'-methyl-
CAS Number:
102433-28-3
Molecular Formula:
C19H27N3O5
Molecular Weight:
377.4348
IUPAC Name:
1-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylpropoxy)-1-benzofuran-5-yl]-1-methylurea
InChI:
InChI=1S/C19H27N3O5/c1-12(22-8-5-6-9-22)11-27-17-14(21(2)19(20)23)15(24-3)13-7-10-26-16(13)18(17)25-4/h7,10,12H,5-6,8-9,11H2,1-4H3,(H2,20,23)
InChI Key:
LXVBINDDGFDUGN-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1c(OCC(N2CCCC2)C)c(OC)c2c(c1OC)cco2
Properties
Complexity:
502
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.195g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
377.441g/mol
Monoisotopic Mass:
377.195g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
90.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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