4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
Basic information
- CAS
782454-84-6- Standard SMILES
CN(C)c1ccc(C(=O)NCC(c2cccs2)N2CCOCC2)cc1- InChIKey
PJLIVLWRABEYAQ-UHFFFAOYSA-N- Molecular formula
- C19H25N3O2S
- Average molar mass
- 359.5 g/mol
- Monoisotopic mass
- 359.16674822
Names & identifiers
- Preferred name
- 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
- IUPAC
- 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
Names & synonyms
4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamideMLS002249158CHEMBL2134631DTXSID101324799HMS3052A17AKOS034446941782454-84-6SMR001316606Z557160984-(dimethylamino)-N-[2-(morpholin-4-yl)-2-(thiophen-2-yl)ethyl]benzamide
Database identifiers
- CAS
782454-84-6- PubChem CID
- 3902828
- DTXSID
DTXSID101324799- ChEMBL
CHEMBL2134631
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 421
Experimental & physicochemical properties
Solubility49.3 [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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