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82267-16-1 | Urea, N,N''-[1,1'-biphenyl]-3,4'-diylbis[N',N'-dimethyl-
CAS No: 82267-16-1 Catalog No: AG0055ZF MDL No:
Product Description
Catalog Number:
AG0055ZF
Chemical Name:
Urea, N,N''-[1,1'-biphenyl]-3,4'-diylbis[N',N'-dimethyl-
CAS Number:
82267-16-1
Molecular Formula:
C18H22N4O2
Molecular Weight:
326.3929
IUPAC Name:
3-[3-[4-(dimethylcarbamoylamino)phenyl]phenyl]-1,1-dimethylurea
InChI:
InChI=1S/C18H22N4O2/c1-21(2)17(23)19-15-10-8-13(9-11-15)14-6-5-7-16(12-14)20-18(24)22(3)4/h5-12H,1-4H3,(H,19,23)(H,20,24)
InChI Key:
LDFIDHYZUZEHGZ-UHFFFAOYSA-N
SMILES:
O=C(N(C)C)Nc1ccc(cc1)c1cccc(c1)NC(=O)N(C)C
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.174g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
326.4g/mol
Monoisotopic Mass:
326.174g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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