Basic information
- CAS
103344-19-0- Standard SMILES
O=c1c2cc(-c3ccccc3)sc2nc2sc(-c3ccccc3)nn12- InChIKey
ZJENAUVDXNVXPT-UHFFFAOYSA-N- Molecular formula
- C19H11N3OS2
- Average molar mass
- 361.4 g/mol
- Monoisotopic mass
- 361.03435433
Names & identifiers
- Preferred name
- 8H-(1,3,4)Thiadiazolo(3,2-a)thieno(2,3-d)pyrimidin-8-one, 2,6-diphenyl-
- IUPAC
- 5,11-diphenyl-6,10-dithia-1,8,12-triazatricyclo[7.3.0.03,7]dodeca-3(7),4,8,11-tetraen-2-one
Names & synonyms
BRN 56143698H-(1,3,4)Thiadiazolo(3,2-a)thieno(2,3-d)pyrimidin-8-one, 2,6-diphenyl-103344-19-02,6-Diphenyl-8H-(1,3,4)thiadiazolo(3,2-a)thieno(2,3-d)pyrimidin-8-oneDTXSID301457912,6-Diphenyl-8H-[1,3,4]thiadiazolo[3,2-a]thieno[2,3-d]pyrimidin-8-oneRefChem:312392DTXCID0068282NSC622186CHEMBL1990725NSC-622186NCI60_006458
Show more names
2,6-diphenyl-[1,3,4]thiadiazolo[[?]]thieno[[?]]pyrimidin-8-one8H-[1,3,4]Thiazolo[3,2-a]thieno[2,3-d]pyrimidin-8-one, 2,6-diphenyl-8H-[1,4]Thiazolo[3,2a]thieno[2,3d]pyrimidin-8-one, 2,6-diphenyl-
Database identifiers
- CAS
103344-19-0- PubChem CID
- 360208
- DTXSID
DTXSID30145791- ChEMBL
CHEMBL1990725
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 98.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 608
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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