Basic information
- CAS
609796-23-8- Standard SMILES
C=CCOc1ccc(-c2cc(C(F)(F)F)c3c(N)c(C(=O)Nc4ccc(OC)cc4)sc3n2)cc1- InChIKey
QUBYWHHFCLENRB-UHFFFAOYSA-N- Molecular formula
- C25H20F3N3O3S
- Average molar mass
- 499.5 g/mol
- Monoisotopic mass
- 499.11774717
Names & identifiers
- Preferred name
- 6-[4-(Allyloxy)phenyl]-3-amino-N-(4-methoxyphenyl)-4-(trifluoromethyl)thieno[2,3-B]pyridine-2-carboxamide
- IUPAC
- 3-amino-N-(4-methoxyphenyl)-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
- English name
- SALOR-INT L434884-1EA
- Molecular formula
- C25H20F3N3O3S
- Molecular weight
- 499.5
Names & synonyms
6-[4-(allyloxy)phenyl]-3-amino-N-(4-methoxyphenyl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide6-(4-(ALLYLOXY)PHENYL)-3-AMINO-N-(4-METHOXYPHENYL)-4-(TRIFLUOROMETHYL)THIENO(2,3-B)PYRIDINE-2-CARBOXAMIDERefChem:539362609796-23-8646-092-1STK880492AKOS0016849933-amino-N-(4-methoxyphenyl)-6-[4-(prop-2-en-1-yloxy)phenyl]-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamideEU-00830373-amino-N-(4-methoxyphenyl)-6-{4-[(prop-2-en-1-yl)oxy]phenyl}-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamideSALOR-INT L434884-1EA3-amino-N-(4-methoxyphenyl)-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
Show more names
Thieno[2,3-b]pyridine-2-carboxamide, 3-amino-N-(4-methoxyphenyl)-6-[4-(2-propen-1-yloxy)phenyl]-4-(trifluoromethyl)-
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 726
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H413
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, 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 CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H413
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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