6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

C180H160Cl5F18N29O12S — CID 158839562

IUPAC6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCCc1c(C(=O)NCc2ccc3nc(N4CCC(c5ccc(OC(F)(F)F)cc5)CC4)ccc3c2)c2cc(Cl)ccc2n1C.CCc1c(C(=O)NCc2ccc3nc(N4CCC(c5ccc(OC(F)(F)F)cc5)CC4)ccc3c2)c2cc(Cl)cnc2n1C.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2cc(N(C)Cc3ccc(OC(F)(F)F)cc3)cnc2c1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2nc(N(C)Cc3ccc(OC(F)(F)F)cc3)ccc2c1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2ncc(N(C)Cc3ccc(OC(F)(F)F)cc3)cc2c1.Cc1nc2sccn2c1C(=O)NCc1ccc2nc(N(C)Cc3ccc(OC(F)(F)F)cc3)ccc2c1
InChIInChI=1S/C34H32ClF3N4O2.C33H31ClF3N5O2.3C29H25ClF3N5O2.C26H22F3N5O2S/c1-3-29-32(27-19-25(35)8-12-30(27)41(29)2)33(43)39-20-21-4-11-28-24(18-21)7-13-31(40-28)42-16-14-23(15-17-42)22-5-9-26(10-6-22)44-34(36,37)38;1-3-28-30(26-17-24(34)19-38-31(26)41(28)2)32(43)39-18-20-4-10-27-23(16-20)7-11-29(40-27)42-14-12-22(13-15-42)21-5-8-25(9-6-21)44-33(35,36)37;1-3-23-27(38-17-21(30)8-13-26(38)35-23)28(39)34-15-19-6-11-24-20(14-19)7-12-25(36-24)37(2)16-18-4-9-22(10-5-18)40-29(31,32)33;1-3-24-27(38-17-21(30)7-11-26(38)36-24)28(39)35-14-19-6-10-25-20(12-19)13-22(15-34-25)37(2)16-18-4-8-23(9-5-18)40-29(31,32)33;1-3-24-27(38-17-21(30)8-11-26(38)36-24)28(39)35-14-19-4-7-20-13-22(15-34-25(20)12-19)37(2)16-18-5-9-23(10-6-18)40-29(31,32)33;1-16-23(34-11-12-37-25(34)31-16)24(35)30-14-18-5-9-21-19(13-18)6-10-22(32-21)33(2)15-17-3-7-20(8-4-17)36-26(27,28)29/h4-13,18-19,23H,3,14-17,20H2,1-2H3,(H,39,43);4-11,16-17,19,22H,3,12-15,18H2,1-2H3,(H,39,43);4-14,17H,3,15-16H2,1-2H3,(H,34,39);2*4-13,15,17H,3,14,16H2,1-2H3,(H,35,39);3-13H,14-15H2,1-2H3,(H,30,35)
InChIKeyIYBIXHWHXOFUHU-UHFFFAOYSA-N
MW3472.75 g/mol
LogP41.11
Rot. Bonds45

About 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide (PubChem CID 158839562) has the molecular formula C180H160Cl5F18N29O12S and a molecular weight of 3472.75 g/mol. Its IUPAC name is 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound Name6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
PubChem CID158839562
Molecular FormulaC180H160Cl5F18N29O12S
Molecular Weight3472.75 g/mol
Exact Mass3468.07
IUPAC Name6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCCc1c(C(=O)NCc2ccc3nc(N4CCC(c5ccc(OC(F)(F)F)cc5)CC4)ccc3c2)c2cc(Cl)ccc2n1C.CCc1c(C(=O)NCc2ccc3nc(N4CCC(c5ccc(OC(F)(F)F)cc5)CC4)ccc3c2)c2cc(Cl)cnc2n1C.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2cc(N(C)Cc3ccc(OC(F)(F)F)cc3)cnc2c1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2nc(N(C)Cc3ccc(OC(F)(F)F)cc3)ccc2c1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2ncc(N(C)Cc3ccc(OC(F)(F)F)cc3)cc2c1.Cc1nc2sccn2c1C(=O)NCc1ccc2nc(N(C)Cc3ccc(OC(F)(F)F)cc3)ccc2c1
InChIInChI=1S/C34H32ClF3N4O2.C33H31ClF3N5O2.3C29H25ClF3N5O2.C26H22F3N5O2S/c1-3-29-32(27-19-25(35)8-12-30(27)41(29)2)33(43)39-20-21-4-11-28-24(18-21)7-13-31(40-28)42-16-14-23(15-17-42)22-5-9-26(10-6-22)44-34(36,37)38;1-3-28-30(26-17-24(34)19-38-31(26)41(28)2)32(43)39-18-20-4-10-27-23(16-20)7-11-29(40-27)42-14-12-22(13-15-42)21-5-8-25(9-6-21)44-33(35,36)37;1-3-23-27(38-17-21(30)8-13-26(38)35-23)28(39)34-15-19-6-11-24-20(14-19)7-12-25(36-24)37(2)16-18-4-9-22(10-5-18)40-29(31,32)33;1-3-24-27(38-17-21(30)7-11-26(38)36-24)28(39)35-14-19-6-10-25-20(12-19)13-22(15-34-25)37(2)16-18-4-8-23(9-5-18)40-29(31,32)33;1-3-24-27(38-17-21(30)8-11-26(38)36-24)28(39)35-14-19-4-7-20-13-22(15-34-25(20)12-19)37(2)16-18-5-9-23(10-6-18)40-29(31,32)33;1-16-23(34-11-12-37-25(34)31-16)24(35)30-14-18-5-9-21-19(13-18)6-10-22(32-21)33(2)15-17-3-7-20(8-4-17)36-26(27,28)29/h4-13,18-19,23H,3,14-17,20H2,1-2H3,(H,39,43);4-11,16-17,19,22H,3,12-15,18H2,1-2H3,(H,39,43);4-14,17H,3,15-16H2,1-2H3,(H,34,39);2*4-13,15,17H,3,14,16H2,1-2H3,(H,35,39);3-13H,14-15H2,1-2H3,(H,30,35)
InChIKeyIYBIXHWHXOFUHU-UHFFFAOYSA-N
XLogP41.11
TPSA418.71 Ų
H-Bond Donors6
H-Bond Acceptors36
Rotatable Bonds45
Heavy Atoms245
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003472.75
LogP ≤ 541.11
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1036

Analyze 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide with MolForge

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Related Compounds

1-(6-Chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-(3-fluoro-4-thiomorpholin-4-ylphenyl)propan-1-one;3-(2,3-dihydro-1-benzofuran-5-yl)-1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]phenyl]propan-1-one;1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)-3-[3-fluoro-4-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]phenyl]propan-1-one
CID 159748248
CID 161929905
CID 161929905
7-Benzyl-8-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propylpurine-2,6-dione;8-[(2-chloroimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-3-ethyl-7-[[4-(2-oxopropyl)phenyl]methyl]purine-2,6-dione;3-ethyl-8-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-[[4-(2-oxopropyl)phenyl]methyl]purine-2,6-dione;3-ethyl-7-[(4-methoxyphenyl)methyl]-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]purine-2,6-dione;3-ethyl-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-7-[(4-methylphenyl)methyl]purine-2,6-dione
CID 160662613
7-Benzyl-8-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-propylpurine-2,6-dione;8-[(2-chloroimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-3-ethyl-7-[[4-(2-oxopropyl)phenyl]methyl]purine-2,6-dione;3-ethyl-7-[(4-fluorophenyl)methyl]-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]purine-2,6-dione;3-ethyl-7-[(4-methoxyphenyl)methyl]-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]purine-2,6-dione
CID 160988794
3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl-[1-(3-chlorophenyl)benzimidazol-5-yl]methanone;[3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone;[3-(3-chlorophenyl)-1H-indol-6-yl]-piperidin-1-ylmethanone;[3-(3-chlorophenyl)-1-methylindol-6-yl]-piperidin-1-ylmethanone;[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone;piperidin-1-yl-[1-(1,3-thiazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]methanone
CID 164952450
3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl-[1-(3-chlorophenyl)benzimidazol-5-yl]methanone;[3-chloro-1-(2-methylpyrimidin-5-yl)pyrrolo[2,3-b]pyridin-5-yl]-(4-methylpiperidin-1-yl)methanone;[3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone;[3-(3-chlorophenyl)-1H-indol-6-yl]-piperidin-1-ylmethanone;[3-(3-chlorophenyl)-1-methylindol-6-yl]-piperidin-1-ylmethanone;[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone;piperidin-1-yl-[1-(1,3-thiazol-4-yl)pyrrolo[2,3-b]pyridin-5-yl]methanone
CID 167675722

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The IUPAC name of 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide (CID 158839562) is 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide.
What is the SMILES notation for 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The canonical SMILES for 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide is CCc1c(C(=O)NCc2ccc3nc(N4CCC(c5ccc(OC(F)(F)F)cc5)CC4)ccc3c2)c2cc(Cl)ccc2n1C.CCc1c(C(=O)NCc2ccc3nc(N4CCC(c5ccc(OC(F)(F)F)cc5)CC4)ccc3c2)c2cc(Cl)cnc2n1C.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2cc(N(C)Cc3ccc(OC(F)(F)F)cc3)cnc2c1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2nc(N(C)Cc3ccc(OC(F)(F)F)cc3)ccc2c1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2ncc(N(C)Cc3ccc(OC(F)(F)F)cc3)cc2c1.Cc1nc2sccn2c1C(=O)NCc1ccc2nc(N(C)Cc3ccc(OC(F)(F)F)cc3)ccc2c1.
What is the InChIKey of 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The InChIKey is IYBIXHWHXOFUHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H32ClF3N4O2.C33H31ClF3N5O2.3C29H25ClF3N5O2.C26H22F3N5O2S/c1-3-29-32(27-19-25(35)8-12-30(27)41(29)2)33(43)39-20-21-4-11-28-24(18-21)7-13-31(40-28)42-16-14-23(15-17-42)22-5-9-26(10-6-22)44-34(36,37)38;1-3-28-30(26-17-24(34)19-38-31(26)41(28)2)32(43)39-18-20-4-10-27-23(16-20)7-11-29(40-27)42-14-12-22(13-15-42)21-5-8-25(9-6-21)44-33(35,36)37;1-3-23-27(38-17-21(30)8-13-26(38)35-23)28(39)34-15-19-6-11-24-20(14-19)7-12-25(36-24)37(2)16-18-4-9-22(10-5-18)40-29(31,32)33;1-3-24-27(38-17-21(30)7-11-26(38)36-24)28(39)35-14-19-6-10-25-20(12-19)13-22(15-34-25)37(2)16-18-4-8-23(9-5-18)40-29(31,32)33;1-3-24-27(38-17-21(30)8-11-26(38)36-24)28(39)35-14-19-4-7-20-13-22(15-34-25(20)12-19)37(2)16-18-5-9-23(10-6-18)40-29(31,32)33;1-16-23(34-11-12-37-25(34)31-16)24(35)30-14-18-5-9-21-19(13-18)6-10-22(32-21)33(2)15-17-3-7-20(8-4-17)36-26(27,28)29/h4-13,18-19,23H,3,14-17,20H2,1-2H3,(H,39,43);4-11,16-17,19,22H,3,12-15,18H2,1-2H3,(H,39,43);4-14,17H,3,15-16H2,1-2H3,(H,34,39);2*4-13,15,17H,3,14,16H2,1-2H3,(H,35,39);3-13H,14-15H2,1-2H3,(H,30,35).
What are the key properties of 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide has a molecular weight of 3472.75 g/mol, XLogP of 41.11, 45 rotatable bonds, 6 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-ethyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-7-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]indole-3-carboxamide;5-chloro-2-ethyl-1-methyl-N-[[2-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]quinolin-6-yl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;6-methyl-N-[[2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]quinolin-6-yl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 158839562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).