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86764-31-0 | Urea, N'-(4-butylphenyl)-N,N-bis(phenylmethyl)-
CAS No: 86764-31-0 Catalog No: AG004SBM MDL No:
Product Description
Catalog Number:
AG004SBM
Chemical Name:
Urea, N'-(4-butylphenyl)-N,N-bis(phenylmethyl)-
CAS Number:
86764-31-0
Molecular Formula:
C25H28N2O
Molecular Weight:
372.5026
IUPAC Name:
1,1-dibenzyl-3-(4-butylphenyl)urea
InChI:
InChI=1S/C25H28N2O/c1-2-3-10-21-15-17-24(18-16-21)26-25(28)27(19-22-11-6-4-7-12-22)20-23-13-8-5-9-14-23/h4-9,11-18H,2-3,10,19-20H2,1H3,(H,26,28)
InChI Key:
NPRJBCKKFKTBNB-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)NC(=O)N(Cc1ccccc1)Cc1ccccc1
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.22g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
372.512g/mol
Monoisotopic Mass:
372.22g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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