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Bz-rC Phosphoramidite

CAT: 0931-T38566Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T38566Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
118380-84-0
Target
DNA/RNA Synthesis, Others
Related Pathways
Others, Cell Cycle/Checkpoint, DNA Damage/DNA Repair
Bioactivity
Bz-rC Phosphoramidite is a phosphinamide monomer used in oligonucleotide synthesis.
Smiles
COc1ccc(cc1)C(OC[C@H]1O[C@H]([C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1OP(OCCC#N)N(C(C)C)C(C)C)n1ccc(NC(=O)c2ccccc2)nc1=O)(c1ccccc1)c1ccc(OC)cc1
Molecular Formula
C52H66N5O9PSi
Molecular Weight
964.185
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Bz-rC Phosphoramidite
CAS Number118380-84-0
PubChem CID11029435
IUPAC NameN-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-[tert-butyl(dimethyl)silyl]oxy-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]benzamide
Molecular FormulaC52H66N5O9PSi
Molecular Weight964.2
Topological Polar Surface Area153
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count22
Heavy Atom Count68
Formal Charge0
Complexity1690
SMILES
CC(C)N(C(C)C)P(OCCC#N)O[C@@H]1[C@H](O[C@H]([C@@H]1O[Si](C)(C)C(C)(C)C)N2C=CC(=NC2=O)NC(=O)C3=CC=CC=C3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC
InChI
InChI=1S/C52H66N5O9PSi/c1-36(2)57(37(3)4)67(63-34-18-32-53)65-46-44(35-62-52(39-21-16-13-17-22-39,40-23-27-42(60-8)28-24-40)41-25-29-43(61-9)30-26-41)64-49(47(46)66-68(10,11)51(5,6)7)56-33-31-45(55-50(56)59)54-48(58)38-19-14-12-15-20-38/h12-17,19-31,33,36-37,44,46-47,49H,18,34-35H2,1-11H3,(H,54,55,58,59)/t44-,46-,47-,49-,67?/m1/s1
InChIKey
VWNXEDLLHIFAOL-YOVDOAOFSA-N
Chemical Structure
2D Structure
2D structure of Bz-rC Phosphoramidite
CAS: 118380-84-0
CID: 11029435
Formula: C52H66N5O9PSi
MW: 964.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight964.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count22
Exact Mass963.43674223
Monoisotopic Mass963.43674223
Topological Polar Surface Area153 Ų
Heavy Atom Count68
Formal Charge0
Complexity1690
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes