Antineoplastic-315518
Basic information
- CAS
84364-97-6- Standard SMILES
Cc1cn(C2CC(O)C(CS[As](C)C)O2)c(=O)[nH]c1=O- InChIKey
ZPYHRHWYTZXRHT-UHFFFAOYSA-N- Molecular formula
- C12H19AsN2O4S
- Average molar mass
- 362.28 g/mol
- Monoisotopic mass
- 362.028148
Names & identifiers
- Preferred name
- Antineoplastic-315518
- IUPAC
- 1-[5-(dimethylarsanylsulfanylmethyl)-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
Names & synonyms
NSC31551884364-97-6ANTINEOPLASTIC-315518DTXSID70317430NSC-3155181-[2-Deoxy-5-S-(dimethylarsanyl)-5-thiopentofuranosyl]-5-methylpyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
84364-97-6- PubChem CID
- 330033
- DTXSID
DTXSID70317430
Properties
Computed structural properties
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 443
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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