Basic information
- Standard SMILES
O=C(Cn1nc(C(F)(F)F)c2c1CCCC2)Nc1cc2c(s1)CCCC2- InChIKey
YBFMRPMKBVTMRW-UHFFFAOYSA-N- Molecular formula
- C18H20F3N3OS
- Average molar mass
- 383.4 g/mol
- Monoisotopic mass
- 383.12791793
Names & identifiers
- Preferred name
- N-(4,5,6,7-Tetrahydro-benzo[b]thiophen-2-yl)-2-(3-trifluoromethyl-4,5,6,7-tetrahydro indazol-1-yl)-acetamide
- IUPAC
- N-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetamide
Names & synonyms
N-(4,5,6,7-Tetrahydro-benzo[b]thiophen-2-yl)-2-(3-trifluoromethyl-4,5,6,7-tetrahydro indazol-1-yl)-acetamideSCHEMBL3452806N-(4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-2-(3-trifluoromethyl-4,5,6,7-tetrahydroindazol-1-yl)-acetamide
Database identifiers
- PubChem CID
- 59520488
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 532
Related reactions
4 records
Compound notes
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