1-[5-o-Carbamoyl-2,3-o-(1-methylethylidene)pentofuranosyl]pyrimidine-2,4(1h,3h)-dione
Basic information
- CAS
41509-93-7- Standard SMILES
CC1(C)OC2C(COC(N)=O)OC(n3ccc(=O)[nH]c3=O)C2O1- InChIKey
PSHKQESDGOBINT-UHFFFAOYSA-N- Molecular formula
- C13H17N3O7
- Average molar mass
- 327.29 g/mol
- Monoisotopic mass
- 327.10664989
Names & identifiers
- Preferred name
- 1-[5-o-Carbamoyl-2,3-o-(1-methylethylidene)pentofuranosyl]pyrimidine-2,4(1h,3h)-dione
- IUPAC
- [4-(2,4-dioxopyrimidin-1-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl carbamate
Names & synonyms
41509-93-71-[5-o-carbamoyl-2,3-o-(1-methylethylidene)pentofuranosyl]pyrimidine-2,4(1h,3h)-dioneNSC148460DTXSID10302082NSC-1484605160-27-0
Database identifiers
- CAS
41509-93-7- PubChem CID
- 288046
- DTXSID
DTXSID10302082
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 576
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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