3-Amino-N-(2-chloro-5-(trifluoromethyl)phenyl)-6-(2-thienyl)-4-(trifluoromethyl)thieno(2,3-B)pyridine-2-carboxamide
Basic information
- CAS
400864-39-3- Standard SMILES
Nc1c(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)sc2nc(-c3cccs3)cc(C(F)(F)F)c12- InChIKey
GOHZWNCTTSIOPZ-UHFFFAOYSA-N- Molecular formula
- C20H10ClF6N3OS2
- Average molar mass
- 521.9 g/mol
- Monoisotopic mass
- 520.985801
Names & identifiers
- Preferred name
- 3-Amino-N-(2-chloro-5-(trifluoromethyl)phenyl)-6-(2-thienyl)-4-(trifluoromethyl)thieno(2,3-B)pyridine-2-carboxamide
- IUPAC
- 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-thiophen-2-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
Names & synonyms
3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-(2-thienyl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide3-Amino-N-(2-chloro-5-(trifluoromethyl)phenyl)-6-(2-thienyl)-4-(trifluoromethyl)thieno(2,3-B)pyridine-2-carboxamideRefChem:497571400864-39-3649-005-5AKOS001643153SR-01000475361SR-01000475361-13-AMINO-N-[2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL]-6-(THIOPHEN-2-YL)-4-(TRIFLUOROMETHYL)THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDE
Database identifiers
- CAS
400864-39-3- PubChem CID
- 3621986
- EC Number
- 649-005-5
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 3
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 729
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, 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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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