Home Sulfos Nalpha-Boc-Nin-mesitylene-2-sulfonyl-L-tryptophan dicyclohexylammonium salt

Nalpha-Boc-Nin-mesitylene-2-sulfonyl-L-tryptophan dicyclohexylammonium salt

CAS No.:
92916-48-8
Catalog Number:
AG0067KG
Molecular Formula:
C37H53N3O6S
Molecular Weight:
667.8982
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 98% (TLC)
1 week
United States
$82
- +
5g
≥ 98% (TLC)
1 week
United States
$221
- +
25g
≥ 98% (TLC)
1 week
United States
$842
- +
100g
≥ 98% (TLC)
1 week
United States
$2363
- +
Product Description
Catalog Number:
AG0067KG
Chemical Name:
Nalpha-Boc-Nin-mesitylene-2-sulfonyl-L-tryptophan dicyclohexylammonium salt
CAS Number:
92916-48-8
Molecular Formula:
C37H53N3O6S
Molecular Weight:
667.8982
MDL Number:
MFCD00065596
IUPAC Name:
N-cyclohexylcyclohexanamine;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]propanoic acid
InChI:
InChI=1S/C25H30N2O6S.C12H23N/c1-15-11-16(2)22(17(3)12-15)34(31,32)27-14-18(19-9-7-8-10-21(19)27)13-20(23(28)29)26-24(30)33-25(4,5)6;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h7-12,14,20H,13H2,1-6H3,(H,26,30)(H,28,29);11-13H,1-10H2/t20-;/m0./s1
InChI Key:
KFHJVPFHYDLKGK-BDQAORGHSA-N
SMILES:
C1CCC(CC1)NC1CCCCC1.O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1cn(c2c1cccc2)S(=O)(=O)c1c(C)cc(cc1C)C
Properties
Complexity:
953  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
667.366g/mol
Formal Charge:
0
Heavy Atom Count:
47  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
667.906g/mol
Monoisotopic Mass:
667.366g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
135A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties