HuagongsheHuagongshe Chemistry Print Report · For research reference only
6-(Piperazin-1-yl)pyridine-3-carbonitrile → 6-(4-(3-(5-(2,2,2-Trifluoroacetyl)thiophen-2-yl)benzoyl)piperazin-1-yl)nicotinonitrile
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 6-(Piperazin-1-yl)pyridine-3-carbonitrile | HCID 2737184 | — |
| Reactant | 3-[5-(Trifluoroacetyl)thiophen-2-yl]benzoic Acid | HCID 24896624 | — |
| Solvent | Formic Acid | HCID 284 | — |
| Product | 6-(4-(3-(5-(2,2,2-Trifluoroacetyl)thiophen-2-yl)benzoyl)piperazin-1-yl)nicotinonitrile | HCID 53327859 | 32% |
Reaction Steps
This compound was synthesized from 6-(piperazin-1-yl)nicotinonitrile and 3-(5-(2,2,2-trifluoroacetyl)thiophen-2-yl)benzoic acid as described for example 37 step 3 (60 mg, yield 32%). 1H NMR (400 MHz, DMSO-d6) δ 8.52 (d, J=2.1 Hz, 1H), 8.19-8.17 (dd, J=4.0 Hz, J=1.5 Hz, 1H), 8.00-7.89 (m, 4H), 7.64-7.61 (m, 1H), 7.57-7.55 (m, 1H), 6.96-6.94 (t, J=9.2 Hz, 1H), 3.82-3.74 (m, 6H), 3.47 (m, 2H). MS (ESI) m/z: Calculated for C23H17F3N4O2S: 470.10. found: 515.6 (M+HCOOH)−
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08981084B2 |
| Source dataset | uspto-grants-2015_03 |
| ORD ID | ord-f2284173873a4381826bb57d555c1e9c |
| Source note | uspto-grants-2015_03 |