200,000+ products from a single source!
sales@angenechem.com
82339-36-4 | lysine-iodoacetylmethotrexate
CAS No: 82339-36-4 Catalog No: AG00GJUA MDL No:
Product Description
Catalog Number:
AG00GJUA
Chemical Name:
lysine-iodoacetylmethotrexate
CAS Number:
82339-36-4
IUPAC Name:
(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-6-[(2-iodoacetyl)amino]hexanoic acid
InChI:
InChI=1S/C23H28IN9O4/c1-33(12-14-11-28-20-18(29-14)19(25)31-23(26)32-20)15-7-5-13(6-8-15)21(35)30-16(22(36)37)4-2-3-9-27-17(34)10-24/h5-8,11,16H,2-4,9-10,12H2,1H3,(H,27,34)(H,30,35)(H,36,37)(H4,25,26,28,31,32)/t16-/m0/s1
InChI Key:
NDRPUTRIAJPVPS-INIZCTEOSA-N
Properties
Complexity:
771
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
621.131g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
621.44g/mol
Monoisotopic Mass:
621.131g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
202A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.