HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 23987Generated: October 29, 2026
Benzyl isocyanate → Methyl 3-[5-(3-{[benzylamino]carbonylamino}propoxy)indolyl]propanoate
https://huagongshe.com/reaction/23987
Participants
| Role | Name | HCID | Charge |
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| Reactant | Benzyl isocyanate | HCID 76639 | — |
| Reactant | Methyl 3-[5-(aminopropoxy)indolyl]propanoate | HCID 66819503 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | Methyl 3-[5-(3-{[benzylamino]carbonylamino}propoxy)indolyl]propanoate | HCID 22570288 | 42% |
Reaction Steps
To the solution of methyl 3-[5-(aminopropoxy)indolyl]propanoate (140 mg, 0.5 mmol), as prepared in the preceding step, in acetonitrile (10 mL) was added benzyl isocynate (135 mg, 1.0 mmol), and the mixture was stirred at ambient temperature overnight. After evaporating the solvent in vacuo, the residue was purified by flash column chromatography on silica gel (methylene chloride to 5% ethyl acetate in methylene chloride) to give the title compound as a white solid (85 mg, 42%). 1H-NMR (400 MHz, CDCl3) δ 7.28 (m, 5H), 7.20 (d, J=8.9 Hz, 1H), 7.10 (d, J=2.8 Hz, 1H), 7.05 (d, J=2.5 Hz, 1H), 6.81 (dd, J=8.8, 2.5 Hz, 1H), 6.38 (d, J=2.9 Hz, 1H), 4.66 (br s, 2H), 4.41 (t, J=6.8 Hz, 2H), 4.35 (d, J=5.7 Hz, 2H), 4.06 (t, J=5.8 Hz, 2H), 3.66 (s, 3H), 3.43 (q, J=6.2 Hz, 2H), 2.81 (t, J=6.8 Hz, 2H), 1.99 (t, J=6.1, 2H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US06855722B2 |
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| Source dataset | uspto-grants-2005_02 |
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| ORD ID | ord-14aec1e9b3f74212a43cb4f44187fb0e |
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| Source note | uspto-grants-2005_02 |
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