2-Pentofuranosyl-2h-indazole-3-carbonitrile
Basic information
- CAS
31818-85-6- Standard SMILES
N#Cc1c2ccccc2nn1C1OC(CO)C(O)C1O- InChIKey
IYLAPMMXZCLSFG-UHFFFAOYSA-N- Molecular formula
- C13H13N3O4
- Average molar mass
- 275.26 g/mol
- Monoisotopic mass
- 275.0906059
Names & identifiers
- Preferred name
- 2-Pentofuranosyl-2h-indazole-3-carbonitrile
- IUPAC
- 2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]indazole-3-carbonitrile
Names & synonyms
31818-85-62-pentofuranosyl-2h-indazole-3-carbonitrileNSC140856DTXSID20953741NSC-140856DS-0041342H-INDAZOLE-3-CARBONITRILE,2-B-D-RIBOFURANOSYL-
Database identifiers
- CAS
31818-85-6- PubChem CID
- 284699
- DTXSID
DTXSID20953741
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 412
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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