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27686-50-6 | L-Cysteine, N,S-bis(triphenylmethyl)-
CAS No: 27686-50-6 Catalog No: AG002UFQ MDL No:
Product Description
Catalog Number:
AG002UFQ
Chemical Name:
L-Cysteine, N,S-bis(triphenylmethyl)-
CAS Number:
27686-50-6
Molecular Formula:
C41H35NO2S
Molecular Weight:
605.7871
IUPAC Name:
(2R)-2-(tritylamino)-3-tritylsulfanylpropanoic acid
InChI:
InChI=1S/C41H35NO2S/c43-39(44)38(42-40(32-19-7-1-8-20-32,33-21-9-2-10-22-33)34-23-11-3-12-24-34)31-45-41(35-25-13-4-14-26-35,36-27-15-5-16-28-36)37-29-17-6-18-30-37/h1-30,38,42H,31H2,(H,43,44)/t38-/m0/s1
InChI Key:
OJBZHLUHWUVJEL-LHEWISCISA-N
SMILES:
OC(=O)[C@@H](NC(c1ccccc1)(c1ccccc1)c1ccccc1)CSC(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
779
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
605.239g/mol
Formal Charge:
0
Heavy Atom Count:
45
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
605.796g/mol
Monoisotopic Mass:
605.239g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
Literature
| Title | Journal |
|---|---|
| Synthesis and biological evaluation of L-cysteine derivatives as mitotic kinesin Eg5 inhibitors. | Bioorganic & medicinal chemistry letters 20070715 |
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