Basic information
- CAS
1524731-70-1- Standard SMILES
CC(C)Oc1nc(NN)nc(Sc2ccc(Cl)cn2)n1- InChIKey
YCANMINQNMUAHJ-UHFFFAOYSA-N- Molecular formula
- C11H13ClN6OS
- Average molar mass
- 312.78 g/mol
- Monoisotopic mass
- 312.0560079
Names & identifiers
- Preferred name
- 1,3,5-Triazine, 2-[(5-chloro-2-pyridinyl)thio]-4-hydrazinyl-6-(1-methylethoxy)-
- IUPAC
- [4-[(5-chloro-2-pyridinyl)sulfanyl]-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
Names & synonyms
DTXSID801136163AKOS0194983011,3,5-Triazine, 2-[(5-chloro-2-pyridinyl)thio]-4-hydrazinyl-6-(1-methylethoxy)-1524731-70-12-[(5-Chloropyridin-2-yl)sulfanyl]-4-hydrazinylidene-6-[(propan-2-yl)oxy]-1,4-dihydro-1,3,5-triazine
Database identifiers
- CAS
1524731-70-1- PubChem CID
- 80929488
- DTXSID
DTXSID801136163
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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