Basic information
- CAS
6315-15-7- Standard SMILES
NNC(=O)CSc1ncnc2nc[nH]c12- InChIKey
HYSYTVDBONGUGM-UHFFFAOYSA-N- Molecular formula
- C7H8N6OS
- Average molar mass
- 224.25 g/mol
- Monoisotopic mass
- 224.04803007
Names & identifiers
- Preferred name
- Acetic acid, (9H-purin-6-ylthio)-, hydrazide
- IUPAC
- 2-(7H-purin-6-ylsulfanyl)acetohydrazide
Names & synonyms
6315-15-7NSC20091NSC-20091BAS 00231905Oprea1_327974Oprea1_4510542-purin-6-ylthioacetohydrazideCHEMBL472576DTXSID00345680HYSYTVDBONGUGM-UHFFFAOYSA-N2-(9H-purin-6-ylthio)acetohydrazideAcethydrazide, 2-(purin-6-ylthio)-
Show more names
AKOS000588822AKOS0323948642-((7H-purin-6-yl)thio)acetohydrazide2-(9H-Purin-6-ylsulfanyl)acetohydrazide2-(9H-Purin-6-ylsulfanyl)acetohydrazide #2-[(7H-Purin-6-yl)sulfanyl]acetohydrazideST50219705Acetic acid, (9H-purin-6-ylthio)-, hydrazide
Database identifiers
- CAS
6315-15-7- PubChem CID
- 606325
- DTXSID
DTXSID00345680- ChEMBL
CHEMBL472576
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 240
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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