Free Chemical Databases
-
[Synonyms]
NSC241503
79692-14-1
[Structure]
[ Properties Computed from Structure]
Molecular Weight 537.94704 [g/mol] Molecular Formula C34H71N3O XLogP 9.8 H-Bond Donor 0 H-Bond Acceptor 3 Rotatable Bond Count 28 Exact Mass 537.559714 MonoIsotopic Mass 537.559714 Topological Polar Surface Area 26.8 Heavy Atom Count 38 Formal Charge 0 Complexity 480 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 2 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: N,N-bis(5-diethylaminopentan-2-yl)hexadecanamide
Canonical SMILES: CCCCCCCCCCCCCCCC(=O)N(C(C)CCCN(CC)CC)C(C)CCCN(CC)CC
InChI: InChI=1/C34H71N3O/c1-8-13-14-15-16-17-18-19-20-21-22-23-24-29-34(38)37
(32(6)27-25-30-35(9-2)10-3)33(7)28-26-31-36(11-4)12-5/h32-33H,8-31H2,
1-7H3
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