4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine

C135H157F3N24O13 — CID 157078987

IUPAC4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine
SMILESCCOc1ccc(-n2c(C)c3c(C)nnc(N4CCCN(c5ccccc5)CC4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(N4CCn5c(Cc6ccccc6)cnc5C4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(NCCN4CCOCC4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(NCc4ccccc4OC)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(Nc4ccc(OC(F)(F)F)cc4)c3c2C)c(OC)c1
InChIInChI=1S/C31H34N6O2.C29H35N5O2.C26H30N4O3.C25H25F3N4O3.C24H33N5O3/c1-6-39-25-12-13-26(27(17-25)38-5)37-21(3)29-20(2)33-34-31(30(29)22(37)4)35-14-15-36-24(18-32-28(36)19-35)16-23-10-8-7-9-11-23;1-6-36-24-13-14-25(26(19-24)35-5)34-21(3)27-20(2)30-31-29(28(27)22(34)4)33-16-10-15-32(17-18-33)23-11-8-7-9-12-23;1-7-33-20-12-13-21(23(14-20)32-6)30-17(3)24-16(2)28-29-26(25(24)18(30)4)27-15-19-10-8-9-11-22(19)31-5;1-6-34-19-11-12-20(21(13-19)33-5)32-15(3)22-14(2)30-31-24(23(22)16(32)4)29-17-7-9-18(10-8-17)35-25(26,27)28;1-6-32-19-7-8-20(21(15-19)30-5)29-17(3)22-16(2)26-27-24(23(22)18(29)4)25-9-10-28-11-13-31-14-12-28/h7-13,17-18H,6,14-16,19H2,1-5H3;7-9,11-14,19H,6,10,15-18H2,1-5H3;8-14H,7,15H2,1-6H3,(H,27,29);7-13H,6H2,1-5H3,(H,29,31);7-8,15H,6,9-14H2,1-5H3,(H,25,27)
InChIKeyADHOHFWVYXSGLP-UHFFFAOYSA-N
MW2380.89 g/mol
LogP26.30
Rot. Bonds36

About 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine

4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine (PubChem CID 157078987) has the molecular formula C135H157F3N24O13 and a molecular weight of 2380.89 g/mol. Its IUPAC name is 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine.

Molecular Properties

Compound Name4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine
PubChem CID157078987
Molecular FormulaC135H157F3N24O13
Molecular Weight2380.89 g/mol
Exact Mass2379.23
IUPAC Name4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine
SMILESCCOc1ccc(-n2c(C)c3c(C)nnc(N4CCCN(c5ccccc5)CC4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(N4CCn5c(Cc6ccccc6)cnc5C4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(NCCN4CCOCC4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(NCc4ccccc4OC)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(Nc4ccc(OC(F)(F)F)cc4)c3c2C)c(OC)c1
InChIInChI=1S/C31H34N6O2.C29H35N5O2.C26H30N4O3.C25H25F3N4O3.C24H33N5O3/c1-6-39-25-12-13-26(27(17-25)38-5)37-21(3)29-20(2)33-34-31(30(29)22(37)4)35-14-15-36-24(18-32-28(36)19-35)16-23-10-8-7-9-11-23;1-6-36-24-13-14-25(26(19-24)35-5)34-21(3)27-20(2)30-31-29(28(27)22(34)4)33-16-10-15-32(17-18-33)23-11-8-7-9-12-23;1-7-33-20-12-13-21(23(14-20)32-6)30-17(3)24-16(2)28-29-26(25(24)18(30)4)27-15-19-10-8-9-11-22(19)31-5;1-6-34-19-11-12-20(21(13-19)33-5)32-15(3)22-14(2)30-31-24(23(22)16(32)4)29-17-7-9-18(10-8-17)35-25(26,27)28;1-6-32-19-7-8-20(21(15-19)30-5)29-17(3)22-16(2)26-27-24(23(22)18(29)4)25-9-10-28-11-13-31-14-12-28/h7-13,17-18H,6,14-16,19H2,1-5H3;7-9,11-14,19H,6,10,15-18H2,1-5H3;8-14H,7,15H2,1-6H3,(H,27,29);7-13H,6H2,1-5H3,(H,29,31);7-8,15H,6,9-14H2,1-5H3,(H,25,27)
InChIKeyADHOHFWVYXSGLP-UHFFFAOYSA-N
XLogP26.30
TPSA340.41 Ų
H-Bond Donors3
H-Bond Acceptors37
Rotatable Bonds36
Heavy Atoms175
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002380.89
LogP ≤ 526.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1037

Analyze 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine with MolForge

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Related Compounds

(E)-3-chloro-N-[2-[2-(dimethylamino)ethoxy]-4-methoxy-5-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethoxy]-5-[[4-(1,2-dimethylindol-3-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethoxy]-5-[[4-[1-(2-fluoroethyl)indol-3-yl]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethoxy]-4-methoxy-5-[[4-(2-methylindazol-3-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide;(E)-N-[2-[2-(dimethylamino)ethoxy]-4-methoxy-5-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]phenyl]-4,4,4-trifluorobut-2-enamide
CID 157375358
tetrakis(1-(2,4-difluorobenzene-6-id-1-yl)-3-(2,4-difluorophenyl)-4,5-diphenyl-2H-imidazol-3-ium-2-ide);bis(1-(2,4-dimethoxybenzene-6-id-1-yl)-3-(2,4-dimethoxyphenyl)-4,5-diphenyl-2H-imidazol-3-ium-2-ide);tris(iridium);2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)pyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 157684416
2-(1,2-diaza-3-azanidacyclopenta-1,4-dien-4-yl)pyridine;hexakis(1-(2,4-dimethoxybenzene-6-id-1-yl)-3-(2,4-dimethoxyphenyl)-4,5-diphenyl-2H-imidazol-3-ium-2-ide);tris(iridium);2-pyrazol-2-id-3-ylpyridine;2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine
CID 157978955
5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)-7-methoxyquinazolin-4-amine;5-[(4R)-3,3-difluoro-1-methylpiperidin-4-yl]oxy-7-methoxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-[3-methyl-4-(1-methylbenzotriazol-5-yl)oxyphenyl]quinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-(3-methyl-4-pyrazolo[1,5-a]pyridin-6-yloxyphenyl)quinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-4-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazoline-4,7-diamine
CID 158101638
3-ethyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline;methane;2-(methoxymethyl)-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline;3-(methoxymethyl)-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline;4-(methoxymethyl)-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline;4-methoxy-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2-(trifluoromethoxy)aniline
CID 158484096
2-chloro-N-[2,4-dimethoxy-5-[[4-(2-methylindazol-3-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide;(E)-3-chloro-N-[2,4-dimethoxy-5-[[4-(2-methylindazol-3-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide;N-[2,4-dimethoxy-5-[[4-(2-methylindazol-3-yl)pyrimidin-2-yl]amino]phenyl]-2-fluoroprop-2-enamide;(E)-N-[2,4-dimethoxy-5-[[4-(2-methylindazol-3-yl)pyrimidin-2-yl]amino]phenyl]-4,4,4-trifluorobut-2-enamide;N-[2-[2-(dimethylamino)ethoxy]-5-[[4-(1,2-dimethylindol-3-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide
CID 158780974
5-(1-azabicyclo[2.2.2]octan-4-yloxy)-N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)quinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-[2-fluoro-5-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]-7-methoxyquinazolin-4-amine;5-[2-(difluoromethyl)piperidin-4-yl]oxy-N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)quinazolin-4-amine;5-[(4S)-3,3-difluoropiperidin-4-yl]oxy-7-methoxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;5-(1-ethyl-3,3-difluoropiperidin-4-yl)oxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;5-(3-fluoro-1-methylpiperidin-4-yl)oxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine
CID 159038128
2-chloro-N-[2-[2-(dimethylamino)ethoxy]-5-[[4-(1,2-dimethylindol-3-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;(E)-3-chloro-N-[2-[2-(dimethylamino)ethoxy]-5-[[4-(1,2-dimethylindol-3-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethoxy]-5-[[4-(1,2-dimethylindol-3-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]-2-fluoroprop-2-enamide;(E)-N-[2-[2-(dimethylamino)ethoxy]-5-[[4-(1,2-dimethylindol-3-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]-4,4,4-trifluorobut-2-enamide;N-[2-[2-(dimethylamino)ethoxy]-4-methoxy-5-[[4-(1-methylindazol-3-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide
CID 159147796
N-(3-chloro-4-methoxyphenyl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-N-(3-ethoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;N-[6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-yl]-N',N'-diethylpropane-1,3-diamine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-[2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]pyrrolo[3,4-d]pyridazine
CID 159510258
5-(5,5-difluoro-1-methylazepan-4-yl)oxy-N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)quinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-[4-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-7-yl)oxy]-3-methylphenyl]-6-methoxyquinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-[4-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-7-yl)oxy]-3-methylphenyl]-7-methoxyquinazolin-4-amine;5-[3,3-difluoro-1-(trideuteriomethyl)piperidin-4-yl]oxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;5-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]-5-[1-(trideuteriomethyl)-2-(trifluoromethyl)piperidin-4-yl]oxyquinazolin-4-amine
CID 159529857
2-(1,2-diaza-3-azanidacyclopenta-1,4-dien-4-yl)pyridine;pentakis(1-(2,4-dimethoxybenzene-6-id-1-yl)-3-(2,4-dimethoxyphenyl)-4,5-dimethyl-2H-imidazol-3-ium-2-ide);3-(2,4-dimethoxybenzene-6-id-1-yl)-1-(2,4-dimethoxyphenyl)-4-methyl-2H-imidazol-1-ium-2-ide;tris(iridium);2-pyrazol-2-id-3-ylpyridine;2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine
CID 159890228
5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)-7-methoxyquinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-[3-methyl-4-(1-methylbenzimidazol-5-yl)oxyphenyl]quinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-N-(3-methyl-4-pyrazolo[1,5-a]pyridin-6-yloxyphenyl)quinazolin-4-amine;5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-4-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazoline-4,7-diamine;5-(1-ethyl-3,3-difluoropiperidin-4-yl)oxy-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine;5-(3-fluoro-1-methylpiperidin-4-yl)oxy-N-(4-imidazo[1,2-a]pyridin-7-yloxy-3-methylphenyl)quinazolin-4-amine
CID 159940010

Frequently Asked Questions

What is the IUPAC name of 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine?
The IUPAC name of 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine (CID 157078987) is 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine.
What is the SMILES notation for 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine?
The canonical SMILES for 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine is CCOc1ccc(-n2c(C)c3c(C)nnc(N4CCCN(c5ccccc5)CC4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(N4CCn5c(Cc6ccccc6)cnc5C4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(NCCN4CCOCC4)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(NCc4ccccc4OC)c3c2C)c(OC)c1.CCOc1ccc(-n2c(C)c3c(C)nnc(Nc4ccc(OC(F)(F)F)cc4)c3c2C)c(OC)c1.
What is the InChIKey of 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine?
The InChIKey is ADHOHFWVYXSGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H34N6O2.C29H35N5O2.C26H30N4O3.C25H25F3N4O3.C24H33N5O3/c1-6-39-25-12-13-26(27(17-25)38-5)37-21(3)29-20(2)33-34-31(30(29)22(37)4)35-14-15-36-24(18-32-28(36)19-35)16-23-10-8-7-9-11-23;1-6-36-24-13-14-25(26(19-24)35-5)34-21(3)27-20(2)30-31-29(28(27)22(34)4)33-16-10-15-32(17-18-33)23-11-8-7-9-12-23;1-7-33-20-12-13-21(23(14-20)32-6)30-17(3)24-16(2)28-29-26(25(24)18(30)4)27-15-19-10-8-9-11-22(19)31-5;1-6-34-19-11-12-20(21(13-19)33-5)32-15(3)22-14(2)30-31-24(23(22)16(32)4)29-17-7-9-18(10-8-17)35-25(26,27)28;1-6-32-19-7-8-20(21(15-19)30-5)29-17(3)22-16(2)26-27-24(23(22)18(29)4)25-9-10-28-11-13-31-14-12-28/h7-13,17-18H,6,14-16,19H2,1-5H3;7-9,11-14,19H,6,10,15-18H2,1-5H3;8-14H,7,15H2,1-6H3,(H,27,29);7-13H,6H2,1-5H3,(H,29,31);7-8,15H,6,9-14H2,1-5H3,(H,25,27).
What are the key properties of 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine?
4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine has a molecular weight of 2380.89 g/mol, XLogP of 26.30, 36 rotatable bonds, 3 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethylpyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1,5,7-trimethylpyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-(2-morpholin-4-ylethyl)pyrrolo[3,4-d]pyridazin-4-amine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-4-(4-phenyl-1,4-diazepan-1-yl)pyrrolo[3,4-d]pyridazine;6-(4-ethoxy-2-methoxyphenyl)-1,5,7-trimethyl-N-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-d]pyridazin-4-amine is sourced from PubChem (CID 157078987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).