Benzo[a][1,4]benzothiazino[3,2-c]phenothiazine
Basic information
- CAS
214-97-1- Standard SMILES
c1ccc2c(c1)N=c1c(c3c(c4ccccc14)=Nc1ccccc1S3)S2- InChIKey
JGYAWMNADRIACS-UHFFFAOYSA-N- Molecular formula
- C22H12N2S2
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.04419074
Names & identifiers
- Preferred name
- Benzo[a][1,4]benzothiazino[3,2-c]phenothiazine
- IUPAC
- 3,26-dithia-10,19-diazahexacyclo[16.8.0.02,11.04,9.012,17.020,25]hexacosa-1,4,6,8,10,12,14,16,18,20,22,24-dodecaene
- English name
- Benzo(a)(1,4)benzothiazino(3,2-c)phenothiazine
- Molecular formula
- C22H12N2S2
- Molecular weight
- 368.47
Names & synonyms
Benzo[a][1,4]benzothiazino[3,2-c]phenothiazineOprea1_246727DTXSID703996955,10-Diaza-15,16-dithiabenzo[h]pentaphene15,16-Dithia-5,10-diazabenzo[h]pentapheneBenzo(a)(1,4)benzothiazino(3,2-c)phenothiazine15,16-Dithia-5,10-diazanaphtho[2,3-a]benz[c]anthrasene
Database identifiers
- CAS
214-97-1- PubChem CID
- 4131804
- DTXSID
DTXSID70399695- Nikkaji
- J442.603G
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 636
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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