Basic information
- CAS
128435-26-7- Standard SMILES
COc1ccc(C(OCC2OC(n3ccc(NC(=O)c4ccccc4)nc3=O)CC2O)(c2ccccc2)c2ccc(OC)cc2)cc1- InChIKey
MYSNCIZBPUPZMQ-UHFFFAOYSA-N- Molecular formula
- C37H35N3O7
- Average molar mass
- 633.7 g/mol
- Monoisotopic mass
- 633.24750046
Overview
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Names & identifiers
- Preferred name
- N-[1-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]benzamide
- IUPAC
- N-[1-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-2-oxopyrimidin-4-yl]benzamide
Names & synonyms
5'-O-(4,4'-Dimethoxytrityl)-N4-benzoyl-2'-deoxycytidine1-{5-O-[bis(4-methoxyphenyl)(phenyl)methyl]-2-deoxypentofuranosyl}-4-[(phenylcarbonyl)amino]pyrimidin-2(1H)-oneN(4)-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxycytidineN4-Benzoyl-2-deoxy-5-O-DMT-cytidineN4-Benzoyl-5'-O-DMT-2'-deoxycytidineZINC04014603N4-benzoyl-2'-deoxy-5'-O-(4,4'-dimethoxytrityl)-cytidineN-Benzoyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxycytidineorb1690353DTXSID40926134EINECS 266-605-9STK366102
Show more names
ZINC04014589AKOS005443150LS-15390N-[1-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]benzamidePD151340NS00123644N4-Benzoyl -2'-deoxy-5'-O-DMT-D-cytidineT40783
Database identifiers
- CAS
128435-26-7、67219-55-0- PubChem CID
- 3085359
- DTXSID
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 1,080
Related reactions
2 records
Compound notes
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