Basic information
- CAS
70413-86-4- Standard SMILES
Cc1nc2c(sc3ccccc3n2C)c2nc3c(sc4ccccc4n3C)c(C)c12- InChIKey
ATOJLSUPPYWAFC-UHFFFAOYSA-N- Molecular formula
- C24H20N4S2
- Average molar mass
- 428.6 g/mol
- Monoisotopic mass
- 428.112939
Names & identifiers
- Preferred name
- 10,13,15,24-Tetramethyl-3,17-dithia-10,12,24,26-tetrazahexacyclo[12.12.0.02,11.04,9.016,25.018,23]hexacosa-1(26),2(11),4,6,8,12,14,16(25),18,20,22-undecaene
- IUPAC
- 10,13,15,24-tetramethyl-3,17-dithia-10,12,24,26-tetrazahexacyclo[12.12.0.02,11.04,9.016,25.018,23]hexacosa-1(26),2(11),4,6,8,12,14,16(25),18,20,22-undecaene
Names & synonyms
NSC33542770413-86-45,7,8,14-Tetramethyl-5H,14H-[1,4]benzothiazino[3',2':2,3][1,6]naphthyridino[8,7-b][1,4]benzothiazineDTXSID50318763NSC-335427
Database identifiers
- CAS
70413-86-4- PubChem CID
- 333532
- DTXSID
DTXSID50318763
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 82.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 649
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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