200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 130359-85-2
130359-85-2 | Adenosine, N-benzoyl-2'-deoxy-5'-O-(phenylmethyl)-
CAS No: 130359-85-2 Catalog No: AG000UAW MDL No:
Product Description
Catalog Number:
AG000UAW
Chemical Name:
Adenosine, N-benzoyl-2'-deoxy-5'-O-(phenylmethyl)-
CAS Number:
130359-85-2
Molecular Formula:
C24H23N5O4
Molecular Weight:
445.4705
IUPAC Name:
N-[9-[(2R,4S,5R)-4-hydroxy-5-(phenylmethoxymethyl)oxolan-2-yl]purin-6-yl]benzamide
InChI:
InChI=1S/C24H23N5O4/c30-18-11-20(33-19(18)13-32-12-16-7-3-1-4-8-16)29-15-27-21-22(25-14-26-23(21)29)28-24(31)17-9-5-2-6-10-17/h1-10,14-15,18-20,30H,11-13H2,(H,25,26,28,31)/t18-,19+,20+/m0/s1
InChI Key:
ABXIKYZXEAGUBB-XUVXKRRUSA-N
SMILES:
O[C@H]1C[C@@H](O[C@@H]1COCc1ccccc1)n1cnc2c1ncnc2NC(=O)c1ccccc1
Properties
Complexity:
642
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
445.175g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
445.479g/mol
Monoisotopic Mass:
445.175g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.