2,6-Dichloro-5-fluoro-N-(thien-2-ylmethyl)nicotinamide
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Basic information
- CAS
680217-82-7- Standard SMILES
O=C(NCc1cccs1)c1cc(F)c(Cl)nc1Cl- InChIKey
ZSKSDLXPIZNQKW-UHFFFAOYSA-N- Molecular formula
- C11H7Cl2FN2OS
- Average molar mass
- 305.2 g/mol
Names & identifiers
- Preferred name
- 2,6-Dichloro-5-fluoro-N-(thien-2-ylmethyl)nicotinamide
- IUPAC
- 2,6-dichloro-5-fluoro-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
- English name
- 2,6-Dichloro-5-fluoro-N-(thien-2-ylmethyl)nicotinamide
- Molecular formula
- C11H7Cl2FN2OS
- Molecular weight
- 305.16
Names & synonyms
680217-82-72,6-Dichloro-5-fluoro-N-(thien-2-ylmethyl)nicotinamide2,6-Dichloro-5-fluoro-N-(thiophen-2-ylmethyl)nicotinamideMFCD017654552,6-dichloro-5-fluoro-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide2,6-dichloro-5-fluoro-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamideSCHEMBL14426780AKOS025393465PS-7106CS-03313832,6-dichloro-5-fluoro-N-(2-thienylmethyl)pyridine-3-carboxamide2,6-Dichloro-5-fluoro-N-(2-thienylmethyl)-3-pyridinecarboxamide
Show more names
3-Pyridinecarboxamide, 2,6-dichloro-5-fluoro-N-(2-thienylmethyl)-
Database identifiers
- CAS
680217-82-7
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 311
Physicochemical properties
- Melting point
- 145 · 145-146
- Hazard Note
- Harmful
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933399990
- hazard_note
- Harmful
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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