5'-O-DMT-N-(dimethylamino)methylidene-2'-deoxypseudoisocytidine
Basic information
- CAS
307314-30-3- Standard SMILES
COc1ccc(C(OC[C@H]2O[C@@H](c3cnc(N=CN(C)C)[nH]c3=O)C[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1- InChIKey
UYOFMUNLVDBCJK-FRXPANAUSA-N- Molecular formula
- C33H36N4O6
- Average molar mass
- 584.7 g/mol
Names & identifiers
- Preferred name
- 5'-O-DMT-N-(dimethylamino)methylidene-2'-deoxypseudoisocytidine
- IUPAC
- N'-[5-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-6-oxo-1H-pyrimidin-2-yl]-N,N-dimethylmethanimidamide
- English name
- 5'-O-(Dimethoxytrityl)-N-(dimethylamino)methylidene-2'-deoxypseudoisocytidine
- Molecular formula
- C33H36N4O6
- Molecular weight
- 584.66
Names & synonyms
5'-O-DMT-N-(dimethylamino)methylidene-2'-deoxypseudoisocytidine307314-30-3N'-(5-((2R,4S,5R)-5-((Bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-hydroxytetrahydrofuran-2-yl)-6-oxo-1,6-dihydropyrimidin-2-yl)-N,N-dimethylformimidamide5'-O-(Dimethoxytrityl)-N-(dimethylamino)methylidene-2'-deoxypseudoisocytidineN'-[5-[5-O-[Bis(4-methoxyphenyl)phenylmethyl]-2-deoxy-beta-D-erythro-pentofuranosyl]-1,4-dihydro-4-oxo-2-pyrimidinyl]-N,N-dimethylmethanimidamideMethanimidamide, N'-[5-[5-O-[bis(4-methoxyphenyl)phenylmethyl]-2-deoxy-β-D-erythro-pentofuranosyl]-1,4-dihydro-4-oxo-2-pyrimidinyl]-N,N-dimethyl- (9CI)
Database identifiers
- CAS
307314-30-3
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 985
Physicochemical properties
- Density
- 1.25 · 1.250±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 8.721 · 8.721±0.50(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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