Nvp-cgm097

Base Information

Chemical Name:Nvp-cgm097
CAS No.:1313363-54-0
Molecular Formula:C38H47ClN4O4
Molecular Weight:659.269
Hs Code.:
UNII:4UF6MSL0ZH
Nikkaji Number:J3.509.326E
Wikidata:Q27454942
NCI Thesaurus Code:C104280
Pharos Ligand ID:NRC5LN1UHFYK
ChEMBL ID:CHEMBL3601398
Mol file:1313363-54-0.mol

Synonyms:CGM097;NVP-CGM097

Suppliers and Price of Nvp-cgm097

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

DC Chemicals
NVP-CGM097(CGM-097) >98%
1 g
$ 2700.00

Crysdot
NVP-CGM097 98+%
50mg
$ 1590.00

Crysdot
NVP-CGM097 98+%
25mg
$ 837.00

Crysdot
NVP-CGM097 98+%
10mg
$ 409.00

Crysdot
NVP-CGM097 98+%
5mg
$ 239.00

ChemScene
NVP-CGM097 98.32%
10mg
$ 444.00

ChemScene
NVP-CGM097 98.32%
100mg
$ 2520.00

ChemScene
NVP-CGM097 98.32%
50mg
$ 1680.00

ChemScene
NVP-CGM097 98.32%
2mg
$ 144.00

ChemScene
NVP-CGM097 98.32%
5mg
$ 264.00

Total 14 raw suppliers

Chemical Property of Nvp-cgm097

Chemical Property:

Boiling Point:830.1±65.0 °C(Predicted)
PKA:8.31±0.20(Predicted)
PSA：65.56000
Density:1.210±0.06 g/cm3(Predicted)
LogP:6.52430
XLogP3:6.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:658.3285837
Heavy Atom Count:47
Complexity:1040

Purity/Quality:

99%, ^*data from raw suppliers

NVP-CGM097(CGM-097) >98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)OC1=C(C=C2CC(=O)N(C(C2=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)CC5CCC(CC5)N6CCN(C(=O)C6)C)OC
Isomeric SMILES:CC(C)OC1=C(C=C2CC(=O)N([C@H](C2=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)CC5CCC(CC5)N6CCN(C(=O)C6)C)OC
Recent ClinicalTrials:A Phase I Dose Escalation Study of CGM097 in Adult Patients With Selected Advanced Solid Tumors

Technology Process of Nvp-cgm097

There total 28 articles about Nvp-cgm097 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: 98.2%

: 1313365-57-9
(S)-1-(4-chloro-phenyl)-7-isopropoxy-6-methoxy-1,4-dihydro-2H-isoquinolin-3-one

: 1313365-97-7
4-(4-{[(4-iodo-phenyl)-methyl-amino]-methyl}-trans-cyclohexyl)-1-methyl-piperazin-2-one

: 1313363-54-0,1313363-86-8
(S)-1-(4-chloro-phenyl)-7-isopropoxy-6-methoxy-2-(4-{methyl-[4-(4-methyl-3-oxo-piperazin-1-yl)-trans-cyclohexylmethyl]-amino}-phenyl)-1,4-dihydro-2H-isoquinolin-3-one

Guidance literature:: With potassium phosphate; copper(l) iodide; trans-1,2-Diaminocyclohexane; In 1,4-dioxane; at 100 - 170 ℃; for 22.5h; enantioselective reaction; Inert atmosphere;
DOI:10.1021/acs.jmedchem.5b00810

Reference yield: 59.0%

: C₄₄H₅₉ClN₄O₇

: 1313363-54-0,1313363-86-8
(S)-1-(4-chloro-phenyl)-7-isopropoxy-6-methoxy-2-(4-{methyl-[4-(4-methyl-3-oxo-piperazin-1-yl)-trans-cyclohexylmethyl]-amino}-phenyl)-1,4-dihydro-2H-isoquinolin-3-one

Guidance literature:: C₄₄H₅₉ClN₄O₇; With hydrogenchloride; In 1,4-dioxane; at 20 ℃; for 3h;

With triethylamine; In 1,4-dioxane; methanol; at 20 ℃;

Reference yield:

: 14064-15-4
(4-chlorophenyl)trimethylstannane

: 1313363-54-0,1313363-86-8
(S)-1-(4-chloro-phenyl)-7-isopropoxy-6-methoxy-2-(4-{methyl-[4-(4-methyl-3-oxo-piperazin-1-yl)-trans-cyclohexylmethyl]-amino}-phenyl)-1,4-dihydro-2H-isoquinolin-3-one

Guidance literature:: Multi-step reaction with 3 steps

1.1: bis(acetonitrile)(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate / tetrahydrofuran / 20 - 60 °C / Inert atmosphere

2.1: hydrogenchloride / methanol / 0.5 h / 20 °C

2.2: 0.25 h / 20 °C

3.1: trans-1,2-Diaminocyclohexane; potassium phosphate; copper(l) iodide / 1,4-dioxane / 22.5 h / 95 °C / Inert atmosphere

With hydrogenchloride; potassium phosphate; copper(l) iodide; trans-1,2-Diaminocyclohexane; bis(acetonitrile)(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate; In tetrahydrofuran; 1,4-dioxane; methanol;