Basic information
- CAS
1004643-43-9- Standard SMILES
O=C(CCl)Nc1ccn(Cc2c(F)cccc2Cl)n1- InChIKey
NJYFAHBOQWCBEO-UHFFFAOYSA-N- Molecular formula
- C12H10Cl2FN3O
- Average molar mass
- 302.13 g/mol
- Monoisotopic mass
- 301.0184955
Names & identifiers
- Preferred name
- 2-Chloro-N-(1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl)acetamide
- IUPAC
- 2-chloro-N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]acetamide
Names & synonyms
1004643-43-92-Chloro-N-(1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl)acetamide2-chloro-N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]acetamide2-chloro-N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]acetamide2-Chloro-N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}acetamide2-Chloro-N-[1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl]acetamide2-chloro-N-{1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl}acetamideDTXSID1011472782-Chloro-N-[1-(2-chloro-6-fluoro-benzyl)-1H-pyrazol-3-yl]-acetamideSBB022177AKOS000310298
Database identifiers
- CAS
1004643-43-9- PubChem CID
- 7017686
- DTXSID
DTXSID101147278
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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