Benzamide, N-(3-(1,2-diazabicyclo(3.2.2)non-2-yl)propyl)-2-methoxy-5-sulfamoyl-
Basic information
- CAS
100243-26-3- Standard SMILES
COc1ccc(S(N)(=O)=O)cc1C(=O)NCCCN1CCC2CCN1CC2- InChIKey
URZUIOBTBDBOFL-UHFFFAOYSA-N- Molecular formula
- C18H28N4O4S
- Average molar mass
- 396.5 g/mol
- Monoisotopic mass
- 396.18312656
Names & identifiers
- Preferred name
- Benzamide, N-(3-(1,2-diazabicyclo(3.2.2)non-2-yl)propyl)-2-methoxy-5-sulfamoyl-
- IUPAC
- N-[3-(1,2-diazabicyclo[3.2.2]nonan-2-yl)propyl]-2-methoxy-5-sulfamoylbenzamide
- English name
- N-[3-[1,2-Diazabicyclo[3.2.2]nonan-2-yl]propyl]-2-methoxy-5-sulfamoylbenzamide
- Molecular weight
- 0
Names & synonyms
100243-26-3N-(3-(1,2-Diazabicyclo(3.2.2)non-2-yl)propyl)-2-methoxy-5-sulfamoylbenzamideBENZAMIDE, N-(3-(1,2-DIAZABICYCLO(3.2.2)NON-2-YL)PROPYL)-2-METHOXY-5-SULFAMOYL-DTXSID10143053RefChem:322291DTXCID7065544N-[3-(1,2-diazabicyclo[3.2.2]nonan-2-yl)propyl]-2-methoxy-5-sulfamoylbenzamideN-[3-[1,2-Diazabicyclo[3.2.2]nonan-2-yl]propyl]-2-methoxy-5-sulfamoylbenzamide
Database identifiers
- CAS
100243-26-3- PubChem CID
- 57647
- DTXSID
DTXSID10143053- Nikkaji
- J149.088E
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 601
Physicochemical properties
- Comptox DTXSID
- 10143053 · DTXSID10143053
- HS Code
- 2935900090 · 2935900090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2935900090
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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