200,000+ products from a single source!
sales@angenechem.com
156549-47-2 | Adenosine, 2'-deoxy-N-(phenoxyacetyl)-2-[(phenoxyacetyl)amino]- (9CI)
CAS No: 156549-47-2 Catalog No: AG001OSB MDL No:
Product Description
Catalog Number:
AG001OSB
Chemical Name:
Adenosine, 2'-deoxy-N-(phenoxyacetyl)-2-[(phenoxyacetyl)amino]- (9CI)
CAS Number:
156549-47-2
Molecular Formula:
C26H26N6O7
Molecular Weight:
534.5206
IUPAC Name:
N-[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-[(2-phenoxyacetyl)amino]purin-6-yl]-2-phenoxyacetamide
InChI:
InChI=1S/C26H26N6O7/c33-12-19-18(34)11-22(39-19)32-15-27-23-24(28-20(35)13-37-16-7-3-1-4-8-16)30-26(31-25(23)32)29-21(36)14-38-17-9-5-2-6-10-17/h1-10,15,18-19,22,33-34H,11-14H2,(H2,28,29,30,31,35,36)/t18-,19+,22+/m0/s1
InChI Key:
MABTYOCUBSWBGZ-NNMXDRDESA-N
SMILES:
OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1nc(NC(=O)COc1ccccc1)nc2NC(=O)COc1ccccc1
Properties
Complexity:
812
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
534.186g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
534.529g/mol
Monoisotopic Mass:
534.186g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
170A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.