2-[5-Amino-7-(2-propan-2-ylidenehydrazinyl)imidazo[4,5-b]pyridin-3-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Basic information
- CAS
68044-77-9- Standard SMILES
CC(C)=NNc1cc(N)nc2c1ncn2C1OC(CO)C(O)C1O- InChIKey
DEZHPGHXSSRUNY-UHFFFAOYSA-N- Molecular formula
- C14H20N6O4
- Average molar mass
- 336.35 g/mol
- Monoisotopic mass
- 336.15460314
Names & identifiers
- Preferred name
- 2-[5-Amino-7-(2-propan-2-ylidenehydrazinyl)imidazo[4,5-b]pyridin-3-yl]-5-(hydroxymethyl)oxolane-3,4-diol
- IUPAC
- 2-[5-amino-7-(2-propan-2-ylidenehydrazinyl)imidazo[4,5-b]pyridin-3-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
NSC23421068044-77-9DTXSID20310911NSC-2342103-Pentofuranosyl-7-[2-(propan-2-ylidene)hydrazin-1-yl]-3H-imidazo[4,5-b]pyridin-5-amine
Database identifiers
- CAS
68044-77-9- PubChem CID
- 314724
- DTXSID
DTXSID20310911
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 476
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Compound notes
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