Carbamic acid, ((1S,2S,4R)-5-(((1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl)amino)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester

Base Information

Chemical Name:Carbamic acid, ((1S,2S,4R)-5-(((1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl)amino)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester
CAS No.:132619-53-5
Molecular Formula:C₃₃H₄₀N₂O₆
Molecular Weight:560.69
Hs Code.:
DSSTox Substance ID:DTXSID70157671
Nikkaji Number:J384.464A
Wikidata:Q83025824
ChEMBL ID:CHEMBL419923

Carbamic acid, ((1S,2S,4R)-5-(((1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl)amino)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester

Synonyms:CHEMBL419923;132619-53-5;N-t-Butyloxycarbonyl-5-amino-1,6-diphenyl-4-hydroxy-2-(2,3-dihydroxyindanacetylamino)-hexane;Carbamic acid, ((1S,2S,4R)-5-(((1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl)amino)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester;Carbamic acid, [(1S,2S,4R)-5-[[(1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl]amino]-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl]-, 1,1-dimethylethyl ester;BDBM842;SCHEMBL7296216;DTXSID70157671;(2R,4S,5S)-2-Benzyl-5-(tert-butyloxycarbonylamino)-N-[[(1S)-2,3-dihydro-2alpha,3alpha-dihydroxy-1H-inden]-1alpha-yl]-4-hydroxy-6-phenylhexanamide;tert-butyl N-[(1S,2S,4R)-1,4-dibenzyl-5-[[(1S,2S,3R)-2,3-dihydroxyindan-1-yl]amino]-2-hydroxy-5-oxo-pentyl]carbamate;tert-butyl N-[(2S,3S,5R)-5-benzyl-5-{[(1S,2S,3R)-2,3-dihydroxy-2,3-dihydro-1H-inden-1-yl]carbamoyl}-3-hydroxy-1-phenylpentan-2-yl]carbamate

Suppliers and Price of Carbamic acid, ((1S,2S,4R)-5-(((1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl)amino)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Carbamic acid, ((1S,2S,4R)-5-(((1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl)amino)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester

Chemical Property:

Vapor Pressure:3.24E-29mmHg at 25°C
Boiling Point:830.3°C at 760 mmHg
Flash Point:455.9°C
Density:1.26g/cm³
XLogP3:3.8
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:12
Exact Mass:560.28863700
Heavy Atom Count:41
Complexity:834

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CC(CC2=CC=CC=C2)C(=O)NC3C(C(C4=CC=CC=C34)O)O)O
Isomeric SMILES:CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@H](C[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H]3[C@@H]([C@@H](C4=CC=CC=C34)O)O)O

Technology Process of Carbamic acid, ((1S,2S,4R)-5-(((1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl)amino)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester

There total 6 articles about Carbamic acid, ((1S,2S,4R)-5-(((1S,2S,3R)-2,3-dihydro-2,3-dihydroxy-1H-inden-1-yl)amino)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: [(1S,2S,4R)-1-Benzyl-2-(tert-butyl-dimethyl-silanyloxy)-4-((1S,2S,3R)-2,3-dihydroxy-indan-1-ylcarbamoyl)-5-phenyl-pentyl]-carbamic acid tert-butyl ester

: 132619-53-5
N-((1R,2S,3S)-1,2-Dihydroxy-3-indanyl)-5(S)-(1,1-dimethylethoxycarbonylamino)-4(S)-hydroxy-6-phenyl-2(R)-(phenylmethyl)-hexanamide

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran;
DOI:10.1021/jm00107a051

Reference yield:

: 126456-40-4
(1R,2S,3S)-3-Amino-1,2-dihydroxyindan

: 132619-53-5
N-((1R,2S,3S)-1,2-Dihydroxy-3-indanyl)-5(S)-(1,1-dimethylethoxycarbonylamino)-4(S)-hydroxy-6-phenyl-2(R)-(phenylmethyl)-hexanamide

Guidance literature:: Multi-step reaction with 2 steps

1: EDC, HOBT, TEA / dimethylformamide

2: tetrabutylammonium fluoride / tetrahydrofuran

With TEA; tetrabutyl ammonium fluoride; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In tetrahydrofuran; N,N-dimethyl-formamide;
DOI:10.1021/jm00107a051

Reference yield:

: 132565-23-2
(3aS,8aR)-2-Oxo-8,8a-dihydro-3aH-indeno[1,2-d]oxazole-3-carboxylic acid tert-butyl ester

: 132619-53-5
N-((1R,2S,3S)-1,2-Dihydroxy-3-indanyl)-5(S)-(1,1-dimethylethoxycarbonylamino)-4(S)-hydroxy-6-phenyl-2(R)-(phenylmethyl)-hexanamide

Guidance literature:: Multi-step reaction with 5 steps

1: NBS / CCl₄

2: 1.) NaOAc, 2.) aq. NaOH / 1.) DMF, 2.) THF

3: TFA / CH₂Cl₂

4: EDC, HOBT, TEA / dimethylformamide

5: tetrabutylammonium fluoride / tetrahydrofuran

With sodium hydroxide; N-Bromosuccinimide; TEA; tetrabutyl ammonium fluoride; sodium acetate; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; trifluoroacetic acid; In tetrahydrofuran; tetrachloromethane; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm00107a051