(2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl ester

Base Information

Chemical Name:(2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl ester
CAS No.:116308-51-1
Molecular Formula:C₄₁H₄₁N₅O₄
Molecular Weight:667.808
Hs Code.:
DSSTox Substance ID:DTXSID70922003
Nikkaji Number:J355.997A
Mol file:116308-51-1.mol

(2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl ester

Synonyms:116308-51-1;(2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl ester;SCHEMBL7275985;DTXSID70922003;C41H41N5O4;C41-H41-N5-O4;LS-44618;2,6-Dimethyl-4-(4-cyano-2-pyridyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-methyl 5-[2-[4-[(4-benzhydrylpiperazin)-1-yl]phenyl]ethyl] ester;2-{4-[4-(Diphenylmethyl)piperazin-1-yl]phenyl}ethyl methyl 4-cyano-2',6'-dimethyl-1',4'-dihydro[2,4'-bipyridine]-3',5'-dicarboxylate

Suppliers and Price of (2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl ester

Supply Marketing:

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

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Chemical Property of (2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl ester

Chemical Property:

XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:12
Exact Mass:667.31585481
Heavy Atom Count:50
Complexity:1260

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(C(=C(N1)C)C(=O)OCCC2=CC=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C6=NC=CC(=C6)C#N)C(=O)OC

Technology Process of (2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl ester

There total 7 articles about (2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl 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: 59.0%

: 134364-85-5
2-<4-(4-benzhydryl-1-piperazinyl)phenyl>ethyl 2-(4-cyano-2-pyridylmethylidene)acetoacetate

: 21731-17-9
methyl 3-aminocrotonate

: 116308-51-1
2-<4-(4-benzhydryl-1-piperazinyl)phenyl>ethyl methyl 4-(4-cyano-2-pyridyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinecarboxylate

Guidance literature:: In isopropyl alcohol; for 4h; Heating;
DOI:10.1248/cpb.39.91

Reference yield: 48.0%

: 116308-51-1
2-<4-(4-benzhydryl-1-piperazinyl)phenyl>ethyl methyl 4-(4-cyano-2-pyridyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinecarboxylate

Guidance literature:

Reference yield:

: 116308-39-5
2-<4-(1-piperazinyl)phenyl>ethyl alcohol

: 116308-51-1
2-<4-(4-benzhydryl-1-piperazinyl)phenyl>ethyl methyl 4-(4-cyano-2-pyridyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinecarboxylate

Guidance literature:: Multi-step reaction with 3 steps

1: 57 percent / K₂CO₃ / dimethylformamide / 2 h / Ambient temperature

2: 100 percent / DMAP / tetrahydrofuran / 1) ice-salt cooling, 30 min, 2) r.t.

3: propan-2-ol / 40 - 45 °C

With dmap; potassium carbonate; In tetrahydrofuran; N,N-dimethyl-formamide; isopropyl alcohol;
DOI:10.1248/cpb.39.91