Basic information
- CAS
76563-08-1- Standard SMILES
Cc1cn(C2CC(O)C(CCNC(=O)N(C)N=O)O2)c(=O)[nH]c1=O- InChIKey
GWAPPUWNHBYEOS-UHFFFAOYSA-N- Molecular formula
- C13H19N5O6
- Average molar mass
- 341.32 g/mol
- Monoisotopic mass
- 341.13353334
Names & identifiers
- Preferred name
- 3-[2-[3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]ethyl]-1-methyl-1-nitrosourea
- IUPAC
- 3-[2-[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]ethyl]-1-methyl-1-nitrosourea
Names & synonyms
NSC32719076563-08-1DTXSID10318183NSC-3271905-Methyl-1-(2,5,6-trideoxy-6-{[methyl(nitroso)carbamoyl]amino}hexofuranosyl)pyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
76563-08-1- PubChem CID
- 331900
- DTXSID
DTXSID10318183
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 579
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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