[[[5-[(2,5-Difluorophenyl)(4-fluorophenylsulfonyl)methyl]-4-methylpyridin-2-yl]carbonyl]amino]methyl Acetate
Basic information
- Standard SMILES
CC(=O)OCNC(=O)c1cc(C)c(C(c2cc(F)ccc2F)S(=O)(=O)c2ccc(F)cc2)cn1- InChIKey
UYUFOBGNZZCENT-UHFFFAOYSA-N- Molecular formula
- C23H19F3N2O5S
- Average molar mass
- 492.5 g/mol
- Monoisotopic mass
- 492.09667737
Names & identifiers
- Preferred name
- [[[5-[(2,5-Difluorophenyl)(4-fluorophenylsulfonyl)methyl]-4-methylpyridin-2-yl]carbonyl]amino]methyl Acetate
- IUPAC
- [[5-[(2,5-difluorophenyl)-(4-fluorophenyl)sulfonylmethyl]-4-methylpyridine-2-carbonyl]amino]methyl acetate
Names & synonyms
SCHEMBL597008UYUFOBGNZZCENT-UHFFFAOYSA-N[[[5-[(2,5-Difluorophenyl)(4-fluorophenylsulfonyl)methyl]-4-methylpyridin-2-yl]carbonyl]amino]methyl Acetate
Database identifiers
- PubChem CID
- 57736465
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 816
Related reactions
2 records
Compound notes
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