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Home > Other Heterocycles > 89472-90-2
89472-90-2 | Urea, N-bicyclo[2.2.1]hept-2-yl-N'-butyl-N-[(4-methylphenyl)methyl]-
CAS No: 89472-90-2 Catalog No: AG00427N MDL No:
Product Description
Catalog Number:
AG00427N
Chemical Name:
Urea, N-bicyclo[2.2.1]hept-2-yl-N'-butyl-N-[(4-methylphenyl)methyl]-
CAS Number:
89472-90-2
Molecular Formula:
C20H30N2O
Molecular Weight:
314.4650
IUPAC Name:
1-(2-bicyclo[2.2.1]heptanyl)-3-butyl-1-[(4-methylphenyl)methyl]urea
InChI:
InChI=1S/C20H30N2O/c1-3-4-11-21-20(23)22(14-16-7-5-15(2)6-8-16)19-13-17-9-10-18(19)12-17/h5-8,17-19H,3-4,9-14H2,1-2H3,(H,21,23)
InChI Key:
NAUHPNBJPUGJCL-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)N(C1CC2CC1CC2)Cc1ccc(cc1)C
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.236g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.473g/mol
Monoisotopic Mass:
314.236g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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