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88468-04-6 | Urea, N'-(2,4-dimethylphenyl)-N-heptyl-N-(2-phenylethyl)-
CAS No: 88468-04-6 Catalog No: AG004C5C MDL No:
Product Description
Catalog Number:
AG004C5C
Chemical Name:
Urea, N'-(2,4-dimethylphenyl)-N-heptyl-N-(2-phenylethyl)-
CAS Number:
88468-04-6
Molecular Formula:
C24H34N2O
Molecular Weight:
366.5396
IUPAC Name:
3-(2,4-dimethylphenyl)-1-heptyl-1-(2-phenylethyl)urea
InChI:
InChI=1S/C24H34N2O/c1-4-5-6-7-11-17-26(18-16-22-12-9-8-10-13-22)24(27)25-23-15-14-20(2)19-21(23)3/h8-10,12-15,19H,4-7,11,16-18H2,1-3H3,(H,25,27)
InChI Key:
HWQPTLQLYWWQJV-UHFFFAOYSA-N
SMILES:
CCCCCCCN(C(=O)Nc1ccc(cc1C)C)CCc1ccccc1
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.267g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
366.549g/mol
Monoisotopic Mass:
366.267g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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