8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-

Base Information

Chemical Name:8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-
CAS No.:226906-68-9
Molecular Formula:C15H17N5OS
Molecular Weight:315.399
Hs Code.:
DSSTox Substance ID:DTXSID70431685
Wikidata:Q82245635
ChEMBL ID:CHEMBL151603
Mol file:226906-68-9.mol

Synonyms:226906-68-9;8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-;CHEMBL151603;SCHEMBL7211816;SCHEMBL18207310;DTXSID70431685;6-Amino-9-benzyl-2-(propylthio)-7H-purin-8(9H)-one

Suppliers and Price of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:315.11538136
Heavy Atom Count:22
Complexity:390

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCSC1=NC(=C2C(=N1)N(C(=O)N2)CC3=CC=CC=C3)N

Technology Process of 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)-

There total 7 articles about 8H-Purin-8-one, 6-amino-7,9-dihydro-9-(phenylmethyl)-2-(propylthio)- 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: 87.0%

: 226907-70-6
6-Amino-9-benzyl-8-bromo-2-(propylthio)purine

: 226906-68-9
9-benzyl-8-hydroxy-2-propylthioadenine

Guidance literature:: In hydrogenchloride;

Reference yield:

: 226908-20-9
9-benzyl-8-hydroxy-2-mercaptoadenine

: 226906-68-9
9-benzyl-8-hydroxy-2-propylthioadenine

Guidance literature:: 9-benzyl-8-hydroxy-2-mercaptoadenine; With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 1h;

n-propyl halide; In N,N-dimethyl-formamide; at 20 ℃; for 6h; Further stages.;
DOI:10.1021/jm0203581

Reference yield:

: 1-benzoyl-3-(3-benzyl-5-cyano-2-hydroxy-3H-imidazol-4-yl)-thiourea

: 226906-68-9
9-benzyl-8-hydroxy-2-propylthioadenine

: 2-amino-9-benzyl-8-hydroxy-6-propylthiopurine

Guidance literature:: 1-benzoyl-3-(3-benzyl-5-cyano-2-hydroxy-3H-imidazol-4-yl)-thiourea; With sodium hydroxide; In tetrahydrofuran; for 48h; Heating;

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 1h;

C₃H₇X, X=halogen; In N,N-dimethyl-formamide; at 20 ℃; for 6h; Further stages.;
DOI:10.1039/b300557g