N-[2-(Benzylsulfanyl)-6-oxo-1,6-dihydropyrimidin-5-yl]benzamide

Base Information

Chemical Name:N-[2-(Benzylsulfanyl)-6-oxo-1,6-dihydropyrimidin-5-yl]benzamide
CAS No.:109315-25-5
Molecular Formula:C18H15N3O2S
Molecular Weight:337.39600
Hs Code.:
DSSTox Substance ID:DTXSID40550796
Wikidata:Q82430244
Mol file:109315-25-5.mol

Synonyms:109315-25-5;N-(2-(Benzylthio)-4-oxo-1,4-dihydropyrimidin-5-yl)benzamide;DTXSID40550796;N-[2-(Benzylsulfanyl)-6-oxo-1,6-dihydropyrimidin-5-yl]benzamide

Suppliers and Price of N-[2-(Benzylsulfanyl)-6-oxo-1,6-dihydropyrimidin-5-yl]benzamide

Supply Marketing:

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

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Chemical Property of N-[2-(Benzylsulfanyl)-6-oxo-1,6-dihydropyrimidin-5-yl]benzamide

Chemical Property:

PSA：103.90000
LogP:4.11080
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:337.08849790
Heavy Atom Count:24
Complexity:532

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CSC2=NC=C(C(=O)N2)NC(=O)C3=CC=CC=C3

Technology Process of N-[2-(Benzylsulfanyl)-6-oxo-1,6-dihydropyrimidin-5-yl]benzamide

There total 2 articles about N-[2-(Benzylsulfanyl)-6-oxo-1,6-dihydropyrimidin-5-yl]benzamide 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: 74.0%

: 60777-96-0
(Z)-4-(ethoxymethylene)-2-phenyloxazol-5(4H)-one

: 538-28-3,860511-29-1
S-benzylisothiourea hydrochloride

: 109315-25-5
5-benzamido-2-benzylthio-4-hydroxypyrimidine

Guidance literature:: With triethylamine; In ethanol; for 2h; Heating; further S-substituted isothiuronium halides and azlactones; method for preparing S-substituted 2-thiopyrimidines;

Reference yield: 67.0%

: 15646-46-5
4-ethoxymethylene-2-phenyl-2-oxazolin-5-one

: 538-28-3,860511-29-1
S-benzylisothiourea hydrochloride

: 109315-25-5
N-[2-(benzylsulfanyl)-6-oxo-1,6-dihydropyrimidin-5-yl]benzamide

Guidance literature:: With triethylamine; In ethanol; at 100 ℃; for 0.0833333h; under 7500.75 Torr; Microwave irradiation;
DOI:10.1055/s-0029-1218841