4-Butylbenzoic acid → HCID 136333700, compound

HRID 1953021Notes

Reaction equation

HRID 1953021 reaction equation
[CH2:1]([C:5]1[CH:13]=[CH:12][C:8]([C:9]([OH:11])=O)=[CH:7][CH:6]=1)[CH2:2][CH2:3][CH3:4].Cl.[NH2:15][C:16]([NH:18][CH2:19][C:20]1[CH:25]=[CH:24][C:23]([CH2:26][NH:27][C:28](=[O:41])[C@@H:29]([CH2:31][CH2:32][CH2:33][NH:34][C:35]([NH2:40])=[N:36][N+:37]([O-:39])=[O:38])[NH2:30])=[CH:22][CH:21]=1)=[O:17].CN(C(ON1N=NC2C=CC=CC1=2)=[N+](C)C)C.[B-](F)(F)(F)F>>[NH2:15][C:16]([NH:18][CH2:19][C:20]1[CH:21]=[CH:22][C:23]([CH2:26][NH:27][C:28](=[O:41])[C@@H:29]([CH2:31][CH2:32][CH2:33][NH:34][C:35]([NH2:40])=[N:36][N+:37]([O-:39])=[O:38])[NH:30][C:9](=[O:11])[C:8]2[CH:7]=[CH:6][C:5]([CH2:1][CH2:2][CH2:3][CH3:4])=[CH:13][CH:12]=2)=[CH:24][CH:25]=1)=[O:17]

Participants

4

Reactant 3

HCID 886314-Butylbenzoic acidHCID 2733207O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborateHCID 136333697HCID 136333697, compound

Product 1

HCID 136333700HCID 136333700, compoundYield 33%

Procedure

Prepared analogously to Example 69a) from 4-butyl-benzoic acid, (R)-N-[[4-(aminocarbonylaminomethyl)phenyl]methyl]-N5 -[amino(nitroimino)methyl]-ornithinamide-hydrochloride and TBTU in a yield of 33% of theory.

Sources & evidence

ORD record
ord-3c07ca727a834e448dc087735197312d
Source dataset
uspto-grants-2000_09
Patent number
US06114390

Reaction notes

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