Basic information
- CAS
18592-34-2- Standard SMILES
O=C(Nc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(=O)n(C(c2ccccc2)(c2ccccc2)c2ccccc2)c1=O)OCc1ccccc1- InChIKey
FYRNTJDUNDURPE-UHFFFAOYSA-N- Molecular formula
- C50H39N3O4
- Average molar mass
- 745.9 g/mol
- Monoisotopic mass
- 745.29405673
Names & identifiers
- Preferred name
- benzyl N-(2,4-dioxo-1,3-ditritylpyrimidin-5-yl)carbamate
- IUPAC
- benzyl N-(2,4-dioxo-1,3-ditritylpyrimidin-5-yl)carbamate
Names & synonyms
NSC9400618592-34-2DTXSID50329132NSC-94006DS-010505benzyl N-(2,4-dioxo-1,3-ditrityl-pyrimidin-5-yl)carbamate5-Pyrimidinecarbamic acid,2,3,4-tetrahydro-2,4-dioxo-1,3-ditrityl-, benzyl esterBenzyl [2,4-dioxo-1,3-bis(triphenylmethyl)-1,2,3,4-tetrahydropyrimidin-5-yl]carbamate
Database identifiers
- CAS
18592-34-2- PubChem CID
- 417653
- DTXSID
DTXSID50329132
Properties
Computed structural properties
- XLogP
- 10
- Topological polar surface area
- 79 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 1,260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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