Caracasanamide

Base Information

Chemical Name:Caracasanamide
CAS No.:146269-39-8
Molecular Formula:C₂₁H₃₂N₄O₃
Molecular Weight:388.51
Hs Code.:
Nikkaji Number:J575.221C
ChEMBL ID:CHEMBL101090
Mol file:146269-39-8.mol

Synonyms:1-((3,4-dimethoxycinnamoyl)amino)-4-((3-methyl-2-butenyl)guaidino)butane;caracasanamide

Suppliers and Price of Caracasanamide

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of Caracasanamide

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
PSA：98.96000
Density:1.08g/cm³
LogP:4.41540
XLogP3:2.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:12
Exact Mass:388.24744090
Heavy Atom Count:28
Complexity:542

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CCN=C(N)NCCCCNC(=O)C=CC1=CC(=C(C=C1)OC)OC)C
Isomeric SMILES:CC(=CCN=C(N)NCCCCNC(=O)/C=C/C1=CC(=C(C=C1)OC)OC)C

Technology Process of Caracasanamide

There total 13 articles about Caracasanamide 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: 60.0%

: 150785-46-9
(E)-4-2,N³-bis(tert-butoxycarbonyl)-N³-(γ,γ-dimethylallyl)guanidino>-1-<(3,4-dimethoxycinnamoyl)amino>butane

: 146269-39-8
(E)-Caracasanamide

Guidance literature:: With toluene-4-sulfonic acid; In 1,4-dioxane; for 3h; Heating;
DOI:10.1021/jm00072a016

Reference yield:

: 14737-89-4
3,4-dimethoxy-trans-cinnamic acid

: 146269-39-8
(E)-Caracasanamide

Guidance literature:: Multi-step reaction with 3 steps

1: Et₃N / tetrahydrofuran / 2 h / Ambient temperature

2: Et₃N / tetrahydrofuran; CH₂Cl₂ / 2 h / Ambient temperature

3: 60 percent / p-TsOH*H₂O / dioxane / 3 h / Heating

With toluene-4-sulfonic acid; triethylamine; In tetrahydrofuran; 1,4-dioxane; dichloromethane;
DOI:10.1021/jm00072a016

Reference yield:

: 150785-44-7
N,N'-bis(tert-butoxycarbonyl)-N-(γ,γ-dimethylallyl)-S-methylisothiourea

: 146269-39-8
(E)-Caracasanamide

Guidance literature:: Multi-step reaction with 3 steps

1: 69 percent / tetrahydrofuran; H₂O / 1 h / 50 °C

2: Et₃N / tetrahydrofuran; CH₂Cl₂ / 2 h / Ambient temperature

3: 60 percent / p-TsOH*H₂O / dioxane / 3 h / Heating

With toluene-4-sulfonic acid; triethylamine; In tetrahydrofuran; 1,4-dioxane; dichloromethane; water;
DOI:10.1021/jm00072a016