1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)-5-chlorouracil
Basic information
- CAS
133488-41-2- Standard SMILES
N[C@H]1C[C@H](n2cc(Cl)c(=O)[nH]c2=O)OC1[C@@H](O)CO- InChIKey
OARFQCHQOAHGCU-QBARFFCXSA-N- Molecular formula
- C10H14ClN3O5
- Average molar mass
- 291.69 g/mol
- Monoisotopic mass
- 291.0621982
Names & identifiers
- Preferred name
- 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)-5-chlorouracil
- IUPAC
- 1-[(2R,4S)-4-amino-5-[(1S)-1,2-dihydroxyethyl]oxolan-2-yl]-5-chloropyrimidine-2,4-dione
Names & synonyms
133488-41-21-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)-5-chlorouracil2,4(1H,3H)-Pyrimidinedione, 1-(3-amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)-5-chloro-DTXSID909281431-(3-Amino-2,3-dideoxy-.beta.-D-ribo-hexofuranosyl)-5-chlorouracil1-(3-Amino-2,3-dideoxyhexofuranosyl)-5-chloro-4-hydroxypyrimidin-2(1H)-one1-[(2R,4S)-4-amino-5-[(1S)-1,2-dihydroxyethyl]tetrahydrofuran-2-yl]-5-chloro-pyrimidine-2,4-dione1-[(4xi)-3-Amino-2,3-dideoxy-alpha-L-threo-hexofuranosyl]-5-chloro-4-hydroxypyrimidin-2(1H)-one2,4(1H,3H)-Pyrimidinedione, 1-(3-amino-2,3-dideoxy-.beta.-D-ribo-hexofuranosyl)-5-chloro-
Database identifiers
- CAS
133488-41-2- PubChem CID
- 452893
- DTXSID
DTXSID90928143
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 429
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Compound notes
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