Basic information
- CAS
208921-67-9- Standard SMILES
c1ccc(N=c2nnc3c(s2)Nc2ccccc2N3)cc1- InChIKey
VMRIVTHZJABMTG-UHFFFAOYSA-N- Molecular formula
- C15H11N5S
- Average molar mass
- 293.3 g/mol
- Monoisotopic mass
- 293.07351655
Names & identifiers
- Preferred name
- N-Phenyl-1H-[1,3,4]thiadiazino[5,6-B]quinoxalin-3-amine
- IUPAC
- N-phenyl-5,10-dihydro-[1,3,4]thiadiazino[5,6-b]quinoxalin-3-imine
Names & synonyms
208921-67-9N-PHENYL-1H-[1,3,4]THIADIAZINO[5,6-B]QUINOXALIN-3-AMINEDTXSID30782403
Database identifiers
- CAS
208921-67-9- PubChem CID
- 136270331
- DTXSID
DTXSID30782403
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 86.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 492
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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