Basic information
- Standard SMILES
Cc1ccc(NC(=O)c2cc(Cl)ccc2NCC2CCN(C3CCSC3)CC2)nc1- InChIKey
XADSNRYWUAAKNZ-UHFFFAOYSA-N- Molecular formula
- C23H29ClN4OS
- Average molar mass
- 445 g/mol
Names & identifiers
- Preferred name
- 5-Chloro-N-(5-methylpyridin-2-yl)-2-{[1-(tetrahydrothiophen-3-yl)piperidin-4-yl]methylamino}benzamide
- IUPAC
- 5-chloro-N-(5-methyl-2-pyridinyl)-2-[[1-(thiolan-3-yl)piperidin-4-yl]methylamino]benzamide
Names & synonyms
SCHEMBL6107215XADSNRYWUAAKNZ-UHFFFAOYSA-N5-Chloro-N-(5-methylpyridin-2-yl)-2- {[1-(tetrahydrothiophen-3-yl)piperidin-4-yl]methylamino}-benzamide5-Chloro-N-(5-methylpyridin-2-yl)-2-{[1-(tetrahydrothiophen-3-yl)piperidin-4-yl]methylamino}-benzamide5-Chloro-N-(5-methylpyridin-2-yl)-2-{[1-(tetrahydrothiophen-3-yl)piperidin-4-yl]methylamino}benzamide
Database identifiers
- PubChem CID
- 21906321
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 82.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 559
Related reactions
4 records
Compound notes
Loading…