Home Other Building Blocks 2'-DEOXYPSEUDOISOCYTIDINE CEP

2'-DEOXYPSEUDOISOCYTIDINE CEP

CAS No.:
307314-31-4
Catalog Number:
AG00BE0W
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00BE0W
Chemical Name:
2'-DEOXYPSEUDOISOCYTIDINE CEP
CAS Number:
307314-31-4
MDL Number:
MFCD08062071
IUPAC Name:
N'-[5-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyoxolan-2-yl]-6-oxo-1H-pyrimidin-2-yl]-N,N-dimethylmethanimidamide
InChI:
InChI=1S/C42H53N6O7P/c1-29(2)48(30(3)4)56(53-24-12-23-43)55-38-25-37(36-26-44-41(46-40(36)49)45-28-47(5)6)54-39(38)27-52-42(31-13-10-9-11-14-31,32-15-19-34(50-7)20-16-32)33-17-21-35(51-8)22-18-33/h9-11,13-22,26,28-30,37-39H,12,24-25,27H2,1-8H3,(H,44,46,49)/b45-28+/t37-,38+,39-,56?/m1/s1
InChI Key:
QXRSTXQTKUQHPR-IWXRBAEGSA-N
Properties
Complexity:
1350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
1  
Exact Mass:
784.371g/mol
Formal Charge:
0
Heavy Atom Count:
56  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
784.895g/mol
Monoisotopic Mass:
784.371g/mol
Rotatable Bond Count:
19  
Topological Polar Surface Area:
140A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Properties