2,4-Dichloro-N-{[4-(morpholin-4-ylcarbonyl)-1-(propylsulfonyl)piperidin-4-yl]methyl}benzamide
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Basic information
- Standard SMILES
CCCS(=O)(=O)N1CCC(CNC(=O)c2ccc(Cl)cc2Cl)(C(=O)N2CCOCC2)CC1- InChIKey
FQNRAIQUCSDYQF-UHFFFAOYSA-N- Molecular formula
- C21H29Cl2N3O5S
- Average molar mass
- 506.4 g/mol
- Monoisotopic mass
- 505.1204976
Names & identifiers
- Preferred name
- 2,4-Dichloro-N-{[4-(morpholin-4-ylcarbonyl)-1-(propylsulfonyl)piperidin-4-yl]methyl}benzamide
- IUPAC
- 2,4-dichloro-N-[[4-(morpholine-4-carbonyl)-1-propylsulfonylpiperidin-4-yl]methyl]benzamide
Names & synonyms
CHEMBL376472SCHEMBL3850161FQNRAIQUCSDYQF-UHFFFAOYSA-NBDBM501951692,4-dichloro-N-((4-(morpholine-4-carbonyl)-1-(propylsulfonyl)piperidin-4-yl)methyl)benzamide2,4-Dichloro-N-{[4-(morpholin-4-ylcarbonyl)-1-(propylsulfonyl)piperidin-4-yl]methyl}benzamide
Database identifiers
- PubChem CID
- 11699068
- ChEMBL
CHEMBL376472
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 762
Related reactions
2 records
Compound notes
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