Basic information
- CAS
298-48-6- Standard SMILES
CC(C(=O)N1c2ccccc2Sc2ccccc21)[N+](C)(C)C.[Br-]- InChIKey
RLTKVEPESLKRSA-UHFFFAOYSA-M- Molecular formula
- C18H21BrN2OS
- Average molar mass
- 393.3 g/mol
- Monoisotopic mass
- 392.0558
Names & identifiers
- Preferred name
- 10H-Phenothiazine-10-ethanaminium, N,N,N,alpha-tetramethyl-beta-oxo-, bromide (1:1)
- IUPAC
- trimethyl-(1-oxo-1-phenothiazin-10-ylpropan-2-yl)azanium bromide
- English name
- Secergan
- Molecular formula
- C18H21BrN2OS
- Molecular weight
- 393.34114
Names & synonyms
Secergan298-48-6Phenthimentonium bromideYEV5Y7RD0L(1-(10-Phenothiazinylcarbonyl)ethyl)trimethylammonium bromideNSC-40034DTXSID40104337610H-Phenothiazine-10-ethanaminium, N,N,N,alpha-tetramethyl-beta-oxo-, bromide (1:1)[1-(10-Phenothiazinylcarbonyl)ethyl]trimethylammonium bromideRefChem:1057293DTXCID701525955Astra 1470
Show more names
10-(2-Dimethylaminopropionyl) phenothiazine methobromide10-(2-DIMETHYLAMINOPROPIONYL)PHENOTHIAZINE METHOBROMIDEUNII-YEV5Y7RD0LNSC 4003410H-Phenothiazine-10-ethanaminium, N,N,N,alpha-tetramethyl-beta-oxo-, bromideAMMONIUM, (1-(10-PHENOTHIAZINYLCARBONYL)ETHYL)TRIMETHYL-, BROMIDEASTRA-1470GLXC-06466
Database identifiers
- CAS
298-48-6- PubChem CID
- 9277
- DTXSID
DTXSID401043376- UNII
- YEV5Y7RD0L
Properties
Computed structural properties
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 398
Physicochemical properties
- FDA UNII
- 5 Y7RD0L · YEV5Y7RD0L
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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