Octenidine Saccharin
Basic information
- CAS
86767-75-1- Standard SMILES
CCCCCCCCN=c1ccn(CCCCCCCCCCn2ccc(=NCCCCCCCC)cc2)cc1.O=C1NS(=O)(=O)c2ccccc21.O=C1NS(=O)(=O)c2ccccc21- InChIKey
OBHFLBIBWSFADO-UHFFFAOYSA-N- Molecular formula
- C50H72N6O6S2
- Average molar mass
- 917.3 g/mol
- Monoisotopic mass
- 916.49547638
Names & identifiers
- Preferred name
- Octenidine Saccharin
- IUPAC
- bis(1,1-dioxo-1,2-benzothiazol-3-one);N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]pyridin-4-imine
Names & synonyms
Octenidine saccharin86767-75-1octenidine disaccharinWin 41,464-6R337868TDWWIN-41464-6DTXSID102358061-Octanamine, N,N'-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, compound with 1,2-benzisothiazol-3(2H)-one 1,1-dioxide (1:2)RefChem:167847DTXCID00158297Octenidine saccharin [USAN]Octenidine saccharin (USAN)
Show more names
1,1'-Decamethylenebis(1,4-dihydro-4-(octylimino)pyridine) compound with 1,2-benzisothiazolin-3-one 1,1-dioxide (1:2)UNII-R337868TDWorb1740986SCHEMBL1649289CHEMBL2105832SCHEMBL31084223OCTENIDINE DISACCHARIN [MI]1,1-dioxo-1,2-benzothiazol-3-one;N-octyl-1-[10-(4-octyliminopyridin-1-yl)decyl]pyridin-4-imine
Database identifiers
- CAS
86767-75-1- PubChem CID
- 3047799
- DTXSID
DTXSID10235806- ChEMBL
CHEMBL2105832- UNII
- R337868TDW
Properties
Computed structural properties
- Topological polar surface area
- 174 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 25
- Heavy atoms
- 64
- Formal charge
- 0
- Complexity
- 994
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection.
Substances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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