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156730-49-3 | 1,2-Ethanediamine, 1,2-diphenyl-N1,N2-bis[(1R)-1-phenylethyl]-, (1S,2S)-
CAS No: 156730-49-3 Catalog No: AG001OXX MDL No:
Product Description
Catalog Number:
AG001OXX
Chemical Name:
1,2-Ethanediamine, 1,2-diphenyl-N1,N2-bis[(1R)-1-phenylethyl]-, (1S,2S)-
CAS Number:
156730-49-3
Molecular Formula:
C30H32N2
Molecular Weight:
420.5885
IUPAC Name:
(1S,2S)-1,2-diphenyl-N,N'-bis[(1R)-1-phenylethyl]ethane-1,2-diamine
InChI:
InChI=1S/C30H32N2/c1-23(25-15-7-3-8-16-25)31-29(27-19-11-5-12-20-27)30(28-21-13-6-14-22-28)32-24(2)26-17-9-4-10-18-26/h3-24,29-32H,1-2H3/t23-,24-,29+,30+/m1/s1
InChI Key:
OYDUICJTQOQOJF-PEMRLZPOSA-N
SMILES:
C[C@H](c1ccccc1)N[C@H]([C@H](c1ccccc1)N[C@@H](c1ccccc1)C)c1ccccc1
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
420.257g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
420.6g/mol
Monoisotopic Mass:
420.257g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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