CID 13621688

Base Information

Chemical Name:CID 13621688
CAS No.:102152-28-3
Molecular Formula:C₂₅H₃₁N₃O₆
Molecular Weight:469.538
Hs Code.:
DSSTox Substance ID:DTXSID801025203
Nikkaji Number:J1.550.953H

Synonyms:102152-28-3;DTXSID801025203;Ethyl 2-[4-[(2S)-3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]phenyl]-1H-imidazole-5-carboxylate

Suppliers and Price of CID 13621688

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 0 raw suppliers

Chemical Property of CID 13621688

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:14
Exact Mass:469.22128572
Heavy Atom Count:34
Complexity:589

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C1=CN=C(N1)C2=CC=C(C=C2)OCC(CNCCC3=CC(=C(C=C3)OC)OC)O
Isomeric SMILES:CCOC(=O)C1=CN=C(N1)C2=CC=C(C=C2)OC[C@H](CNCCC3=CC(=C(C=C3)OC)OC)O

Technology Process of CID 13621688

There total 4 articles about CID 13621688 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:

: 102151-53-1
2-imidazole-4-carboxylic acid

: 102152-28-3
(S)-4-carbethoxy-2-<4-<3-<<2-(3,4-dimethoxyphenyl)ethyl>amino>-2-hydroxypropoxy>phenyl>imidazole

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) NaH / 1.) DMF, 60 deg C, 0.5 h, 2.) DMF, RT, ovrnight

2: 90 percent / H₂ / 10percent Pd/C / acetic acid / 3 h / 1758.3 Torr

3: 1.) NaH / 1.) DMF, 70 deg C, 15 min, 2.) DMF, 120 deg C, 18 h

4: H₂O, AcOH / 18 h / Ambient temperature

With water; hydrogen; sodium hydride; acetic acid; palladium on activated charcoal; In acetic acid;
DOI:10.1021/jm00156a028

Reference yield:

: 102151-68-8
2--4-carbetoxyimidazole

: 102152-28-3
(S)-4-carbethoxy-2-<4-<3-<<2-(3,4-dimethoxyphenyl)ethyl>amino>-2-hydroxypropoxy>phenyl>imidazole

Guidance literature:: Multi-step reaction with 3 steps

1: 90 percent / H₂ / 10percent Pd/C / acetic acid / 3 h / 1758.3 Torr

2: 1.) NaH / 1.) DMF, 70 deg C, 15 min, 2.) DMF, 120 deg C, 18 h

3: H₂O, AcOH / 18 h / Ambient temperature

With water; hydrogen; sodium hydride; acetic acid; palladium on activated charcoal; In acetic acid;
DOI:10.1021/jm00156a028