3-Amino-N-(2-F-PH)-6-PH-4-(trifluoromethyl)thieno(2,3-B)pyridine-2-carboxamide
Basic information
- CAS
420835-57-0- Standard SMILES
Nc1c(C(=O)Nc2ccccc2F)sc2nc(-c3ccccc3)cc(C(F)(F)F)c12- InChIKey
MJWYGJBBNLBAJA-UHFFFAOYSA-N- Molecular formula
- C21H13F4N3OS
- Average molar mass
- 431.4 g/mol
- Monoisotopic mass
- 431.07154587
Names & identifiers
- Preferred name
- 3-Amino-N-(2-F-PH)-6-PH-4-(trifluoromethyl)thieno(2,3-B)pyridine-2-carboxamide
- IUPAC
- 3-amino-N-(2-fluorophenyl)-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
- English name
- SALOR-INT L224456-1EA
- Molecular formula
- C21H13F4N3OS
- Molecular weight
- 431.41
Names & synonyms
420835-57-03-AMINO-N-(2-F-PH)-6-PH-4-(TRIFLUOROMETHYL)THIENO(2,3-B)PYRIDINE-2-CARBOXAMIDERefChem:497574649-021-23-amino-N-(2-fluorophenyl)-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamideCHEMBL6161186KUC111275NAKOS001644280KSC-230-263-1SR-01000467375SR-01000467375-1SALOR-INT L224456-1EA
Database identifiers
- CAS
420835-57-0- PubChem CID
- 1990763
- ChEMBL
CHEMBL6161186- EC Number
- 649-021-2
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 96.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 616
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H319-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H413-H319-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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