HuagongsheHuagongshe Chemistry Print Report · For research reference only
Benzyl isocyanate → (4-{[Benzyl({[3,5-bis(trifluoromethyl)benzoyl]amino} sulfonyl)amino]methyl}cyclohexyl)methyl 3-methoxyphenylcarbamate
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Benzyl isocyanate | HCID 76639 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | 3-Methoxyphenyl isocyanate | HCID 87843 | — |
| Reactant | (4-{[Benzyl({[3,5-bis(trifluoromethyl)benzoyl]amino}sulfonyl)amino]methyl}cyclohexyl)methyl benzylcarbamate | HCID 22574464 | — |
| Solvent | Triethylamine | HCID 8471 | — |
| Product | (4-{[Benzyl({[3,5-bis(trifluoromethyl)benzoyl]amino} sulfonyl)amino]methyl}cyclohexyl)methyl 3-methoxyphenylcarbamate | HCID 22574485 | — |
Reaction Steps
Following procedure to make (9), 3-methoxyphenyl isocyanate was substituted for benzyl isocyanate and diisopropylethylamine substituted for triethylamine to give the title compound after purification. 1H NMR (500 MHz, DMSO-d6): δ 9.50 (s, 1H), 8.45 (s, 2H), 8.10 (s, 1H), 7.38 (d, 2H), 7.24 (t, 2H), 7.14 (m, 3H), 6.96 (d, 1H), 6.52 (d, 1H), 4.35 (s, 2H), 3.75 (d, 2H), 3.68 (s, 3H), 3.30 (water), 2.89 (d, 2H), 2.48 (DMSO), 1.63 (m, 4H), 1.42 (m, 1H), 1.29 (m, 1H), 0.66 (m, 4H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US06852738B2 |
| Source dataset | uspto-grants-2005_02 |
| ORD ID | ord-3754d13e72ce47f49728e435d6baaf46 |
| Source note | uspto-grants-2005_02 |