Benzenesulfonamide, 4-(4-(3-cyclopentylpropyl)-4,5-dihydro-5-oxo-1H-tetrazol-1-yl)-N-(4-(2-(((2R)-2-hydroxy-2-(3-pyridinyl)ethyl)amino)ethyl)phenyl)-

Base Information

Chemical Name:Benzenesulfonamide, 4-(4-(3-cyclopentylpropyl)-4,5-dihydro-5-oxo-1H-tetrazol-1-yl)-N-(4-(2-(((2R)-2-hydroxy-2-(3-pyridinyl)ethyl)amino)ethyl)phenyl)-
CAS No.:173901-95-6
Molecular Formula:C30H37N7O4S
Molecular Weight:
Hs Code.:
UNII:5DZ9YI6UZ5
Nikkaji Number:J1.097.384H
Pharos Ligand ID:HL8UVBKTTQQU
ChEMBL ID:CHEMBL22375

Benzenesulfonamide, 4-(4-(3-cyclopentylpropyl)-4,5-dihydro-5-oxo-1H-tetrazol-1-yl)-N-(4-(2-(((2R)-2-hydroxy-2-(3-pyridinyl)ethyl)amino)ethyl)phenyl)-

Synonyms:L 770,644;L 770644;L-770,644;L-770644

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Supply Marketing:

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

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Chemical Property of Benzenesulfonamide, 4-(4-(3-cyclopentylpropyl)-4,5-dihydro-5-oxo-1H-tetrazol-1-yl)-N-(4-(2-(((2R)-2-hydroxy-2-(3-pyridinyl)ethyl)amino)ethyl)phenyl)-

Chemical Property:

XLogP3:4.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:14
Exact Mass:591.26277386
Heavy Atom Count:42
Complexity:971

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CCC(C1)CCCN2C(=O)N(N=N2)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)CCNCC(C5=CN=CC=C5)O
Isomeric SMILES:C1CCC(C1)CCCN2C(=O)N(N=N2)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)CCNC[C@@H](C5=CN=CC=C5)O

Technology Process of Benzenesulfonamide, 4-(4-(3-cyclopentylpropyl)-4,5-dihydro-5-oxo-1H-tetrazol-1-yl)-N-(4-(2-(((2R)-2-hydroxy-2-(3-pyridinyl)ethyl)amino)ethyl)phenyl)-

There total 24 articles about Benzenesulfonamide, 4-(4-(3-cyclopentylpropyl)-4,5-dihydro-5-oxo-1H-tetrazol-1-yl)-N-(4-(2-(((2R)-2-hydroxy-2-(3-pyridinyl)ethyl)amino)ethyl)phenyl)- 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: 82.0%

: 202873-16-3
2-(4-{4-[4-(3-cyclopentyl-propyl)-5-oxo-4,5-dihydro-tetrazol-1-yl]-benzenesulfonylamino}-phenyl)-N-(2-hydroxy-2-pyridin-3-yl-ethyl)-acetamide

: 173901-95-6
L 770644

Guidance literature:: With dimethylsulfide borane complex; sulfuric acid; In tetrahydrofuran; at 20 - 50 ℃;
DOI:10.1016/S0040-4039(99)01353-2

Reference yield:

: 190522-06-6
(R)-N-[4-[2-[N-(1,1-Dimethylethoxycarbonyl)-N-[2-Hydroxy-2-(Pyridin-3-Yl)Ethyl]Amino]Ethyl]Phenyl]-4-[4-(3-Cyclopentylpropyl)-5-Tetrazolon-1-Yl]Benzenesulfonamide

: 173901-95-6
L 770644

Guidance literature:: With hydrogenchloride;
DOI:10.1016/S0960-894X(99)00182-1

Reference yield:

: 350-03-8
methyl-3-pyridylketone

: 173901-95-6
L 770644

Guidance literature:: Multi-step reaction with 9 steps

1: NH₂OH*HCl

2: pyridine

3: 82 percent / EtOK; HCl

4: EDC / tetrahydrofuran; H₂O / pH 5.5

5: HCl / H₂O

6: 75 percent / yeast Candida sorbophilia / 48 h / 28 °C / Microbiological reaction

7: 97 percent / H₂; NH₄OH / Pd/C / methanol / 3 h / 40 °C / 1034.3 Torr

8: 94 percent / NaHCO₃ / ethyl acetate; H₂O

9: 82 percent / BH₃*Me₂S; H₂SO₄ / tetrahydrofuran / 20 - 50 °C

With hydrogenchloride; ammonium hydroxide; dimethylsulfide borane complex; yeast Candida sorbophilia; sulfuric acid; hydroxylamine hydrochloride; potassium ethoxide; hydrogen; sodium hydrogencarbonate; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; palladium on activated charcoal; In tetrahydrofuran; pyridine; methanol; water; ethyl acetate; 1: Condensation / 2: Tosylation / 3: Neber rearrangement / 4: Condensation / 5: Hydrolysis / 6: Reduction / 7: Catalytic hydrogenation / 8: Condensation / 9: Reduction;
DOI:10.1016/S0040-4039(99)01353-2