Basic information
- Standard SMILES
CS(=O)(=O)N1CCC(Nc2ccc(C(=O)c3ccccc3F)c(N)n2)CC1- InChIKey
MWIUCXFEGRPYAI-UHFFFAOYSA-N- Molecular formula
- C18H21FN4O3S
- Average molar mass
- 392.4 g/mol
Names & identifiers
- Preferred name
- [2-Amino-6-(1-methanesulfonyl-piperidin4-ylamino)-pyridin-3-yl]-(2-fluoro-phenyl)-methanone
- IUPAC
- [2-amino-6-[(1-methylsulfonylpiperidin-4-yl)amino]-3-pyridinyl]-(2-fluorophenyl)methanone
Names & synonyms
SCHEMBL3837044MWIUCXFEGRPYAI-UHFFFAOYSA-N[2-Amino-6-(1-methanesulfonyl-piperidin4-ylamino)-pyridin-3-yl]-(2-fluoro-phenyl)-methanone
Database identifiers
- PubChem CID
- 11610846
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 619
Related reactions
2 records
Compound notes
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