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20290-40-8 | Urea, N-[(3,4-dimethoxyphenyl)methyl]-N'-1H-inden-3-yl-
CAS No: 20290-40-8 Catalog No: AG0028J7 MDL No:
Product Description
Catalog Number:
AG0028J7
Chemical Name:
Urea, N-[(3,4-dimethoxyphenyl)methyl]-N'-1H-inden-3-yl-
CAS Number:
20290-40-8
Molecular Formula:
C19H20N2O3
Molecular Weight:
324.3737
IUPAC Name:
1-[(3,4-dimethoxyphenyl)methyl]-3-(3H-inden-1-yl)urea
InChI:
InChI=1S/C19H20N2O3/c1-23-17-10-7-13(11-18(17)24-2)12-20-19(22)21-16-9-8-14-5-3-4-6-15(14)16/h3-7,9-11H,8,12H2,1-2H3,(H2,20,21,22)
InChI Key:
PXBVNGXPWQZLIN-UHFFFAOYSA-N
SMILES:
COc1cc(CNC(=O)NC2=CCc3c2cccc3)ccc1OC
Properties
Complexity:
466
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.147g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
324.38g/mol
Monoisotopic Mass:
324.147g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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