3-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-N-(2-morpholin-4-ylethyl)benzamide
Basic information
- CAS
748144-73-2- Standard SMILES
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCN3CCOCC3)ccc2C)cc1- InChIKey
HYQHVYFBLISYQK-UHFFFAOYSA-N- Molecular formula
- C22H29N3O5S
- Average molar mass
- 447.5 g/mol
- Monoisotopic mass
- 447.18279221
Names & identifiers
- Preferred name
- 3-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-N-(2-morpholin-4-ylethyl)benzamide
- IUPAC
- 3-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-N-(2-morpholin-4-ylethyl)benzamide
Names & synonyms
3-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-N-(2-morpholin-4-ylethyl)benzamideMLS002248561CHEMBL1870630DTXSID901323688HMS3082E06AKOS034183865748144-73-2SMR001316023Z324105653-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-N-[2-(morpholin-4-yl)ethyl]benzamide
Database identifiers
- CAS
748144-73-2- PubChem CID
- 2373243
- DTXSID
DTXSID901323688- ChEMBL
CHEMBL1870630
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 655
Experimental & physicochemical properties
Solubility66.4 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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