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DMT-2′Fluoro-dU Phosphoramidite

CAT: 0931-T38958-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T38958-01Size:1 mL - 10 mM (in DMSO)
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
146954-75-8
Target
Nucleoside Antimetabolite/Analog
Related Pathways
DNA Damage/DNA Repair, Cell Cycle/Checkpoint
Purity
0.995
Bioactivity
DMT-2′Fluoro-dU Phosphoramidite (2'-F-dU Phosphoramidite) can be used to modify nucleosides.
Smiles
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](F)[C@@H](O1)N2C(=O)NC(=O)C=C2)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
Molecular Formula
C39H46FN4O8P
Molecular Weight
748.78
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-(((2R,3R,4R,5R)-2-((bis(4-methoxyphenyl)-phenylmethoxy)methyl)-5-(2,4-dioxopyrimidin-1-yl)-4-fluorooxolan-3-yl)oxy-(di(propan-2-yl)amino)phosphanyl)oxypropanenitrile
CAS Number146954-75-8
PubChem CID9810693
IUPAC Name3-[[(2R,3R,4R,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(2,4-dioxopyrimidin-1-yl)-4-fluorooxolan-3-yl]oxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile
Molecular FormulaC39H46FN4O8P
Molecular Weight748.8
XLogP5.3
Topological Polar Surface Area132
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count17
Heavy Atom Count53
Formal Charge0
Complexity1230
SMILES
CC(C)N(C(C)C)P(OCCC#N)O[C@@H]1[C@H](O[C@H]([C@@H]1F)N2C=CC(=O)NC2=O)COC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC
InChI
InChI=1S/C39H46FN4O8P/c1-26(2)44(27(3)4)53(50-24-10-22-41)52-36-33(51-37(35(36)40)43-23-21-34(45)42-38(43)46)25-49-39(28-11-8-7-9-12-28,29-13-17-31(47-5)18-14-29)30-15-19-32(48-6)20-16-30/h7-9,11-21,23,26-27,33,35-37H,10,24-25H2,1-6H3,(H,42,45,46)/t33-,35-,36-,37-,53?/m1/s1
InChIKey
HQHQPAYRJJMYQX-DJTPZYMWSA-N
Chemical Structure
2D Structure
2D structure of 3-(((2R,3R,4R,5R)-2-((bis(4-methoxyphenyl)-phenylmethoxy)methyl)-5-(2,4-dioxopyrimidin-1-yl)-4-fluorooxolan-3-yl)oxy-(di(propan-2-yl)amino)phosphanyl)oxypropanenitrile
CAS: 146954-75-8
CID: 9810693
Formula: C39H46FN4O8P
MW: 748.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight748.8
XLogP35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count17
Exact Mass748.30372960
Monoisotopic Mass748.30372960
Topological Polar Surface Area132 Ų
Heavy Atom Count53
Formal Charge0
Complexity1230
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

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Alternative Products

CatalogName
MBS5785464DMT-2?Fluoro-dU Phosphoramidite
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GTR19170678-01DMT-2′Fluoro-dU Phosphoramidite
M28087-01DMT-dU-CE Phosphoramidite
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HY-1542675'-O-DMT-2-thio-2'-dU-3'-phosphoramidite
GTR19214240-012'-Fluoro-2-thio-2'-dU-3'-phosphoramidite
M-2021-1DU phosphoramidite
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