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921766-26-9

921766-26-9 | Urea, N-[(4-hydroxy-3-methoxyphenyl)methyl]-N'-(phenylmethyl)-

CAS No: 921766-26-9 Catalog No: AG006GKT MDL No:

Product Description

Catalog Number:
AG006GKT
Chemical Name:
Urea, N-[(4-hydroxy-3-methoxyphenyl)methyl]-N'-(phenylmethyl)-
CAS Number:
921766-26-9
Molecular Formula:
C16H18N2O3
Molecular Weight:
286.3257
IUPAC Name:
1-benzyl-3-[(4-hydroxy-3-methoxyphenyl)methyl]urea
InChI:
InChI=1S/C16H18N2O3/c1-21-15-9-13(7-8-14(15)19)11-18-16(20)17-10-12-5-3-2-4-6-12/h2-9,19H,10-11H2,1H3,(H2,17,18,20)
InChI Key:
XAJVKMJRIJXTEK-UHFFFAOYSA-N
SMILES:
COc1cc(CNC(=O)NCc2ccccc2)ccc1O

Properties

Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.132g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
286.331g/mol
Monoisotopic Mass:
286.132g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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