8-Benzylthio-N-butyl cyclic amp

Base Information

Chemical Name:8-Benzylthio-N-butyl cyclic amp
CAS No.:56583-64-3
Molecular Formula:C21H26N5O6PS
Molecular Weight:507.5
Hs Code.:
ChEMBL ID:CHEMBL3142439
Nikkaji Number:J395.245B
Mol file:56583-64-3.mol

Synonyms:8-benzylthio-N(6)-n-butyladenosine cyclic-3,5'-monophosphate;8-benzylthio-N-butyl cyclic AMP;8-BTBCA;N(6)-n-butyl-8-BTCAMP

Suppliers and Price of 8-Benzylthio-N-butyl cyclic amp

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 3 raw suppliers

Chemical Property of 8-Benzylthio-N-butyl cyclic amp

Chemical Property:

PSA：175.96000
LogP:3.17770
XLogP3:1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:8
Exact Mass:507.13414174
Heavy Atom Count:34
Complexity:736

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCNC1=C2C(=NC=N1)N(C(=N2)SCC3=CC=CC=C3)C4C(C5C(O4)COP(=O)(O5)O)O
Isomeric SMILES:CCCCNC1=C2C(=NC=N1)N(C(=N2)SCC3=CC=CC=C3)[C@H]4[C@@H]([C@H]5[C@H](O4)COP(=O)(O5)O)O

Technology Process of 8-Benzylthio-N-butyl cyclic amp

There total 8 articles about 8-Benzylthio-N-butyl cyclic amp 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: 61.0%

: 55628-39-2
2'-O-acetyl-8-(benzylthio)-6-chloro-9-(β-D-ribofuranosyl)purine cyclic 3',5'-phosphate sodium salt

: 109-73-9,85404-21-3
N-butylamine

: 56583-64-3
8-(benzylthio)-6-(n-butylamino)-9-(β-D-ribofuranosyl)purine cyclic 3',5'-phosphate

Guidance literature:: In water; Ambient temperature;
DOI:10.1021/jm00177a007

Reference yield:

: 60-92-4
cAMP

: 56583-64-3
8-(benzylthio)-6-(n-butylamino)-9-(β-D-ribofuranosyl)purine cyclic 3',5'-phosphate

Guidance literature:: Multi-step reaction with 5 steps

1: 146 g / 1,5-diazabicyclo<5.4.0>undec-5-ene, 2,6-lutidine / dimethylformamide / 5 h / 60 °C

2: 1 N aq. NaOH / 2 h / 75 °C

3: H₂ / 5percent Pt/C / acetic acid; H₂O / 5 h / 2068.6 Torr

4: Br₂, NaOAc / acetic acid; H₂O / 72 h / Ambient temperature

5: 30percent aq. NaOH / acetic acid; H₂O / 1 h / 70 °C

With 2,6-dimethylpyridine; sodium hydroxide; hydrogen; bromine; sodium acetate; 1,5-Diazabicyclo[5.4.0]undec-5-ene; platinum on activated charcoal; In water; acetic acid; N,N-dimethyl-formamide;
DOI:10.1021/jm00177a007

Reference yield:

: 72549-57-6
(4aR,6R,7R,7aS)-6-{6-[((E)-But-2-enyl)amino]-purin-9-yl}-2-oxo-tetrahydro-2λ⁵-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol

: 56583-64-3
8-(benzylthio)-6-(n-butylamino)-9-(β-D-ribofuranosyl)purine cyclic 3',5'-phosphate

Guidance literature:: Multi-step reaction with 3 steps

1: H₂ / 5percent Pt/C / acetic acid; H₂O / 5 h / 2068.6 Torr

2: Br₂, NaOAc / acetic acid; H₂O / 72 h / Ambient temperature

3: 30percent aq. NaOH / acetic acid; H₂O / 1 h / 70 °C

With sodium hydroxide; hydrogen; bromine; sodium acetate; platinum on activated charcoal; In water; acetic acid;
DOI:10.1021/jm00177a007