N-(4-isopropoxyphenyl)-4-(6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl)piperazine-1-carboxamide

Base Information

Chemical Name:N-(4-isopropoxyphenyl)-4-(6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl)piperazine-1-carboxamide
CAS No.:401903-53-5
Molecular Formula:C₃₀H₄₀N₆O₅
Molecular Weight:564.685
Hs Code.:
NSC Number:726293
UNII:0VM9M42OBH
Wikidata:Q27231166
Pharos Ligand ID:NFRW39USD5BY
ChEMBL ID:CHEMBL125898

Synonyms:0VM9M42OBH;CT-53608;UNII-0VM9M42OBH;CT 53608;CHEMBL125898;N-(4-isopropoxyphenyl)-4-(6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl)piperazine-1-carboxamide;(4-(6-Methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl)piperazinyl)-N-(4-(methylethoxy)phenyl)carboxamide;1-Piperazinecarboxamide, 4-(6-methoxy-7-(3-(4-morpholinyl)propoxy)-4-quinazolinyl)-N-(4-(1-methylethoxy)phenyl)-;401903-53-5;SCHEMBL317630;BDBM50117319;NSC726293;NSC-726293;Q27231166;4-[6-Methoxy-7-(3-morpholin-4-yl-propoxy)-quinazolin-4-yl]-piperazine-1-carboxylic acid (4-isopropoxy-phenyl)-amide

Suppliers and Price of N-(4-isopropoxyphenyl)-4-(6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl)piperazine-1-carboxamide

Supply Marketing:

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

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Chemical Property of N-(4-isopropoxyphenyl)-4-(6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl)piperazine-1-carboxamide

Chemical Property:

XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:564.30601840
Heavy Atom Count:41
Complexity:785

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)OC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OCCCN5CCOCC5

Technology Process of N-(4-isopropoxyphenyl)-4-(6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl)piperazine-1-carboxamide

There total 11 articles about N-(4-isopropoxyphenyl)-4-(6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl)piperazine-1-carboxamide 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:

: 121-34-6
3-methoxy-4-hydroxybenzoic acid

: 401903-53-5
4-[6-methoxy-7-(3-morpholin-4-yl-propoxy)-quinazolin-4-yl]-piperazine-1-carboxylic acid (4-isopropoxy-phenyl)-amide

Guidance literature:: Multi-step reaction with 11 steps

1.1: 96 percent / K₂CO₃ / dimethylformamide / 20 °C

2.1: 96.5 percent / HNO₃; AcOH / CH₂Cl₂ / 100 °C

3.1: 95 percent / SnCl₂*H₂O / ethyl acetate / 50 °C

4.1: 81 percent / HCOONH₄ / 4 h / 150 °C

5.1: 62 percent / SOCl₂ / dimethylformamide / 4 h / Heating

6.1: 81 percent / DIEA / tetrahydrofuran / 50 °C

7.1: 98 percent / H₂ / Pd(OH)2/C / ethanol / 2585.74 Torr

8.1: 81.9 percent / Cs₂CO₃ / dimethylformamide / 65 °C

9.1: Et₃N / dimethylformamide / 70 °C

10.1: HCl / dioxane / 1 h

11.1: Et₃N / tetrahydrofuran; CH₂Cl₂ / 0.5 h / 20 °C

11.2: 65 mg / Et₃N / tetrahydrofuran; CH₂Cl₂ / 20 °C

With hydrogenchloride; thionyl chloride; hydrogen; nitric acid; ammonium formate; potassium carbonate; caesium carbonate; acetic acid; triethylamine; N-ethyl-N,N-diisopropylamine; tin(ll) chloride; palladium dihydroxide; In tetrahydrofuran; 1,4-dioxane; ethanol; dichloromethane; ethyl acetate; N,N-dimethyl-formamide;
DOI:10.1021/jm020143r

Reference yield:

: 91203-74-6
4-benzyloxy-3-methoxybenzoic acid benzyl ester

: 401903-53-5
4-[6-methoxy-7-(3-morpholin-4-yl-propoxy)-quinazolin-4-yl]-piperazine-1-carboxylic acid (4-isopropoxy-phenyl)-amide

Guidance literature:: Multi-step reaction with 10 steps

1.1: 96.5 percent / HNO₃; AcOH / CH₂Cl₂ / 100 °C

2.1: 95 percent / SnCl₂*H₂O / ethyl acetate / 50 °C

3.1: 81 percent / HCOONH₄ / 4 h / 150 °C

4.1: 62 percent / SOCl₂ / dimethylformamide / 4 h / Heating

5.1: 81 percent / DIEA / tetrahydrofuran / 50 °C

6.1: 98 percent / H₂ / Pd(OH)2/C / ethanol / 2585.74 Torr

7.1: 81.9 percent / Cs₂CO₃ / dimethylformamide / 65 °C

8.1: Et₃N / dimethylformamide / 70 °C

9.1: HCl / dioxane / 1 h

10.1: Et₃N / tetrahydrofuran; CH₂Cl₂ / 0.5 h / 20 °C

10.2: 65 mg / Et₃N / tetrahydrofuran; CH₂Cl₂ / 20 °C

With hydrogenchloride; thionyl chloride; hydrogen; nitric acid; ammonium formate; caesium carbonate; acetic acid; triethylamine; N-ethyl-N,N-diisopropylamine; tin(ll) chloride; palladium dihydroxide; In tetrahydrofuran; 1,4-dioxane; ethanol; dichloromethane; ethyl acetate; N,N-dimethyl-formamide;
DOI:10.1021/jm020143r

Reference yield:

: 162364-72-9
7-benzyloxy-4-chloro-6-methoxyquinazoline

: 401903-53-5
4-[6-methoxy-7-(3-morpholin-4-yl-propoxy)-quinazolin-4-yl]-piperazine-1-carboxylic acid (4-isopropoxy-phenyl)-amide

Guidance literature:: Multi-step reaction with 6 steps

1.1: 81 percent / DIEA / tetrahydrofuran / 50 °C

2.1: 98 percent / H₂ / Pd(OH)2/C / ethanol / 2585.74 Torr

3.1: 81.9 percent / Cs₂CO₃ / dimethylformamide / 65 °C

4.1: Et₃N / dimethylformamide / 70 °C

5.1: HCl / dioxane / 1 h

6.1: Et₃N / tetrahydrofuran; CH₂Cl₂ / 0.5 h / 20 °C

6.2: 65 mg / Et₃N / tetrahydrofuran; CH₂Cl₂ / 20 °C

With hydrogenchloride; hydrogen; caesium carbonate; triethylamine; N-ethyl-N,N-diisopropylamine; palladium dihydroxide; In tetrahydrofuran; 1,4-dioxane; ethanol; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm020143r