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3'-O-TBDMS-2'-dC (Bz)

CAT: 0804-HY-178650Size: 1 EachDry Ice: NoHazardous: No
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Description
3'-O-TBDMS-2'-dC (Bz) is a monomeric raw material that can be used for nucleic acid synthesis.
CAS Number
51549-37-2
UNSPSC
12352005
Target
Nucleoside Antimetabolite/Analog
Related Pathways
Cell Cycle/DNA Damage
Field of Research
Metabolic Disease
Smiles
OC[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H](N(C=CC(NC(C2=CC=CC=C2)=O)=N3)C3=O)O1
Molecular Formula
C22H31N3O5Si
Molecular Weight
445.58
Shipping Conditions
Room temperature
Scientific Category
Oligonucleotides
Clinical Information
No Development Reported

Chemical Information

N-[1-[(2R,4S,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]benzamide
CAS Number51549-37-2
PubChem CID10647001
IUPAC NameN-[1-[(2R,4S,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]benzamide
Molecular FormulaC22H31N3O5Si
Molecular Weight445.6
Topological Polar Surface Area100
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count31
Formal Charge0
Complexity740
SMILES
CC(C)(C)[Si](C)(C)O[C@H]1C[C@@H](O[C@@H]1CO)N2C=CC(=NC2=O)NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C22H31N3O5Si/c1-22(2,3)31(4,5)30-16-13-19(29-17(16)14-26)25-12-11-18(24-21(25)28)23-20(27)15-9-7-6-8-10-15/h6-12,16-17,19,26H,13-14H2,1-5H3,(H,23,24,27,28)/t16-,17+,19+/m0/s1
InChIKey
XZESDHQEKGJAIW-YQVWRLOYSA-N
Chemical Structure
2D Structure
2D structure of N-[1-[(2R,4S,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]benzamide
CAS: 51549-37-2
CID: 10647001
Formula: C22H31N3O5Si
MW: 445.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight445.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass445.20329763
Monoisotopic Mass445.20329763
Topological Polar Surface Area100 Ų
Heavy Atom Count31
Formal Charge0
Complexity740
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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