5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide

C241H214F19N31O30S3 — CID 159636948

IUPAC5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide
SMILESCCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2c(F)c1-c1cccc(C(=O)NC2(c3ncccn3)CC(F)C2)c1)S(C)(=O)=O.CCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2c(F)c1-c1cccc(C(=O)NC2(c3ncccn3)CC(OC(F)F)C2)c1)S(C)(=O)=O.CCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2cc1-c1cccc(C(=O)NC2(c3ncccn3)CC(OC(F)F)C2)c1)S(C)(=O)=O.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)(F)C4)c(OC)cc3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)(F)C4)cc(F)c3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)C4)c(C)cc3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)C4)cc(F)c3C)c(F)c12
InChIInChI=1S/C36H34F3N5O6S.C36H35F2N5O6S.C35H33F2N5O5S.C34H29F3N4O4.C34H30F2N4O3.C33H26F4N4O3.C33H27F3N4O3/c1-5-44(51(4,47)48)25-17-26-28(29(33(46)40-3)31(50-26)21-12-10-20(2)11-13-21)30(37)27(25)22-8-6-9-23(16-22)32(45)43-36(34-41-14-7-15-42-34)18-24(19-36)49-35(38)39;1-5-43(50(4,46)47)28-18-29-27(30(33(45)39-3)31(49-29)22-12-10-21(2)11-13-22)17-26(28)23-8-6-9-24(16-23)32(44)42-36(34-40-14-7-15-41-34)19-25(20-36)48-35(37)38;1-5-42(48(4,45)46)25-17-26-28(29(33(44)38-3)31(47-26)21-12-10-20(2)11-13-21)30(37)27(25)22-8-6-9-23(16-22)32(43)41-35(18-24(36)19-35)34-39-14-7-15-40-34;1-18-6-8-20(9-7-18)29-27(31(43)38-3)26-24(45-29)11-10-21(28(26)35)22-15-23(25(44-4)14-19(22)2)30(42)41-33(16-34(36,37)17-33)32-39-12-5-13-40-32;1-18-6-8-21(9-7-18)30-28(32(42)37-4)27-26(43-30)11-10-23(29(27)36)24-15-25(20(3)14-19(24)2)31(41)40-34(16-22(35)17-34)33-38-12-5-13-39-33;1-17-5-7-19(8-6-17)28-26(30(43)38-3)25-24(44-28)10-9-21(27(25)35)22-13-20(14-23(34)18(22)2)29(42)41-32(15-33(36,37)16-32)31-39-11-4-12-40-31;1-17-5-7-19(8-6-17)29-27(31(42)37-3)26-25(43-29)10-9-22(28(26)36)23-13-20(14-24(35)18(23)2)30(41)40-33(15-21(34)16-33)32-38-11-4-12-39-32/h6-17,24,35H,5,18-19H2,1-4H3,(H,40,46)(H,43,45);6-18,25,35H,5,19-20H2,1-4H3,(H,39,45)(H,42,44);6-17,24H,5,18-19H2,1-4H3,(H,38,44)(H,41,43);5-15H,16-17H2,1-4H3,(H,38,43)(H,41,42);5-15,22H,16-17H2,1-4H3,(H,37,42)(H,40,41);4-14H,15-16H2,1-3H3,(H,38,43)(H,41,42);4-14,21H,15-16H2,1-3H3,(H,37,42)(H,40,41)
InChIKeyMPWDFNFHHRVBHE-UHFFFAOYSA-N
MW4481.71 g/mol
LogP45.03
Rot. Bonds56

About 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide

5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide (PubChem CID 159636948) has the molecular formula C241H214F19N31O30S3 and a molecular weight of 4481.71 g/mol. Its IUPAC name is 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide.

Molecular Properties

Compound Name5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide
PubChem CID159636948
Molecular FormulaC241H214F19N31O30S3
Molecular Weight4481.71 g/mol
Exact Mass4478.50
IUPAC Name5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide
SMILESCCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2c(F)c1-c1cccc(C(=O)NC2(c3ncccn3)CC(F)C2)c1)S(C)(=O)=O.CCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2c(F)c1-c1cccc(C(=O)NC2(c3ncccn3)CC(OC(F)F)C2)c1)S(C)(=O)=O.CCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2cc1-c1cccc(C(=O)NC2(c3ncccn3)CC(OC(F)F)C2)c1)S(C)(=O)=O.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)(F)C4)c(OC)cc3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)(F)C4)cc(F)c3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)C4)c(C)cc3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)C4)cc(F)c3C)c(F)c12
InChIInChI=1S/C36H34F3N5O6S.C36H35F2N5O6S.C35H33F2N5O5S.C34H29F3N4O4.C34H30F2N4O3.C33H26F4N4O3.C33H27F3N4O3/c1-5-44(51(4,47)48)25-17-26-28(29(33(46)40-3)31(50-26)21-12-10-20(2)11-13-21)30(37)27(25)22-8-6-9-23(16-22)32(45)43-36(34-41-14-7-15-42-34)18-24(19-36)49-35(38)39;1-5-43(50(4,46)47)28-18-29-27(30(33(45)39-3)31(49-29)22-12-10-21(2)11-13-22)17-26(28)23-8-6-9-24(16-23)32(44)42-36(34-40-14-7-15-41-34)19-25(20-36)48-35(37)38;1-5-42(48(4,45)46)25-17-26-28(29(33(44)38-3)31(47-26)21-12-10-20(2)11-13-21)30(37)27(25)22-8-6-9-23(16-22)32(43)41-35(18-24(36)19-35)34-39-14-7-15-40-34;1-18-6-8-20(9-7-18)29-27(31(43)38-3)26-24(45-29)11-10-21(28(26)35)22-15-23(25(44-4)14-19(22)2)30(42)41-33(16-34(36,37)17-33)32-39-12-5-13-40-32;1-18-6-8-21(9-7-18)30-28(32(42)37-4)27-26(43-30)11-10-23(29(27)36)24-15-25(20(3)14-19(24)2)31(41)40-34(16-22(35)17-34)33-38-12-5-13-39-33;1-17-5-7-19(8-6-17)28-26(30(43)38-3)25-24(44-28)10-9-21(27(25)35)22-13-20(14-23(34)18(22)2)29(42)41-32(15-33(36,37)16-32)31-39-11-4-12-40-31;1-17-5-7-19(8-6-17)29-27(31(42)37-3)26-25(43-29)10-9-22(28(26)36)23-13-20(14-24(35)18(23)2)30(41)40-33(15-21(34)16-33)32-38-11-4-12-39-32/h6-17,24,35H,5,18-19H2,1-4H3,(H,40,46)(H,43,45);6-18,25,35H,5,19-20H2,1-4H3,(H,39,45)(H,42,44);6-17,24H,5,18-19H2,1-4H3,(H,38,44)(H,41,43);5-15H,16-17H2,1-4H3,(H,38,43)(H,41,42);5-15,22H,16-17H2,1-4H3,(H,37,42)(H,40,41);4-14H,15-16H2,1-3H3,(H,38,43)(H,41,42);4-14,21H,15-16H2,1-3H3,(H,37,42)(H,40,41)
InChIKeyMPWDFNFHHRVBHE-UHFFFAOYSA-N
XLogP45.03
TPSA819.67 Ų
H-Bond Donors14
H-Bond Acceptors44
Rotatable Bonds56
Heavy Atoms324
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004481.71
LogP ≤ 545.03
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1044

Analyze 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide with MolForge

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Related Compounds

5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-ethoxy-2-(4-fluorophenyl)-N-methyl-1-benzofuran-3-carboxamide
CID 130455181
5-[5-[(3,3-dimethoxy-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-2-(4-fluorophenyl)-N-methyl-1-benzofuran-3-carboxamide
CID 130468917
5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-2-(4-fluorophenyl)-N-methyl-6-(propylsulfonylamino)-1-benzofuran-3-carboxamide
CID 155099735
5-[2,4-dimethyl-5-[(1-pyrimidin-2-ylcyclopropyl)carbamoyl]phenyl]-4-fluoro-2-(4-fluorophenyl)-N-methyl-1-benzofuran-3-carboxamide
CID 59275625
6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-5-[4-methyl-3-[2-(3-pyrimidin-2-yloxetan-3-yl)acetyl]phenyl]-1-benzofuran-3-carboxamide
CID 159391332
6-[ethyl(methylsulfonyl)amino]-2-(4-fluorophenyl)-N-methyl-5-[3-[(1-methylcyclopropyl)carbamoyl]phenyl]-1-benzofuran-3-carboxamide;3-fluorophenol
CID 157476011
4-fluoro-2-(4-fluorophenyl)-5-[4-methoxy-2-methyl-5-[(3-pyridin-2-yloxetan-3-yl)carbamoyl]phenyl]-N-methyl-1-benzofuran-3-carboxamide
CID 57381863
5-[3-[(1-cyclopropyl-2,2,2-trifluoroethyl)carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide
CID 134215677
6-[ethyl(methylsulfonyl)amino]-2-(4-fluorophenyl)-N-methyl-5-[3-[[1-(trifluoromethyl)cyclopentyl]carbamoyl]phenyl]-1-benzofuran-3-carboxamide
CID 122499439
4-fluoro-2-(4-fluorophenyl)-5-[4-methoxy-2-methyl-5-[2-(1-methyl-3-pyrimidin-2-ylazetidin-3-yl)acetyl]phenyl]-N-methyl-1-benzofuran-3-carboxamide
CID 157363036
6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-5-phenyl-1-benzofuran-3-carboxamide
CID 162243728
5-[3-(tert-butylcarbamoyl)phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-[4-(4-methylphenoxy)phenyl]-1-benzofuran-3-carboxamide
CID 129088104

Frequently Asked Questions

What is the IUPAC name of 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide?
The IUPAC name of 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide (CID 159636948) is 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide.
What is the SMILES notation for 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide?
The canonical SMILES for 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide is CCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2c(F)c1-c1cccc(C(=O)NC2(c3ncccn3)CC(F)C2)c1)S(C)(=O)=O.CCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2c(F)c1-c1cccc(C(=O)NC2(c3ncccn3)CC(OC(F)F)C2)c1)S(C)(=O)=O.CCN(c1cc2oc(-c3ccc(C)cc3)c(C(=O)NC)c2cc1-c1cccc(C(=O)NC2(c3ncccn3)CC(OC(F)F)C2)c1)S(C)(=O)=O.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)(F)C4)c(OC)cc3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)(F)C4)cc(F)c3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)C4)c(C)cc3C)c(F)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(F)C4)cc(F)c3C)c(F)c12.
What is the InChIKey of 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide?
The InChIKey is MPWDFNFHHRVBHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H34F3N5O6S.C36H35F2N5O6S.C35H33F2N5O5S.C34H29F3N4O4.C34H30F2N4O3.C33H26F4N4O3.C33H27F3N4O3/c1-5-44(51(4,47)48)25-17-26-28(29(33(46)40-3)31(50-26)21-12-10-20(2)11-13-21)30(37)27(25)22-8-6-9-23(16-22)32(45)43-36(34-41-14-7-15-42-34)18-24(19-36)49-35(38)39;1-5-43(50(4,46)47)28-18-29-27(30(33(45)39-3)31(49-29)22-12-10-21(2)11-13-22)17-26(28)23-8-6-9-24(16-23)32(44)42-36(34-40-14-7-15-41-34)19-25(20-36)48-35(37)38;1-5-42(48(4,45)46)25-17-26-28(29(33(44)38-3)31(47-26)21-12-10-20(2)11-13-21)30(37)27(25)22-8-6-9-23(16-22)32(43)41-35(18-24(36)19-35)34-39-14-7-15-40-34;1-18-6-8-20(9-7-18)29-27(31(43)38-3)26-24(45-29)11-10-21(28(26)35)22-15-23(25(44-4)14-19(22)2)30(42)41-33(16-34(36,37)17-33)32-39-12-5-13-40-32;1-18-6-8-21(9-7-18)30-28(32(42)37-4)27-26(43-30)11-10-23(29(27)36)24-15-25(20(3)14-19(24)2)31(41)40-34(16-22(35)17-34)33-38-12-5-13-39-33;1-17-5-7-19(8-6-17)28-26(30(43)38-3)25-24(44-28)10-9-21(27(25)35)22-13-20(14-23(34)18(22)2)29(42)41-32(15-33(36,37)16-32)31-39-11-4-12-40-31;1-17-5-7-19(8-6-17)29-27(31(42)37-3)26-25(43-29)10-9-22(28(26)36)23-13-20(14-24(35)18(23)2)30(41)40-33(15-21(34)16-33)32-38-11-4-12-39-32/h6-17,24,35H,5,18-19H2,1-4H3,(H,40,46)(H,43,45);6-18,25,35H,5,19-20H2,1-4H3,(H,39,45)(H,42,44);6-17,24H,5,18-19H2,1-4H3,(H,38,44)(H,41,43);5-15H,16-17H2,1-4H3,(H,38,43)(H,41,42);5-15,22H,16-17H2,1-4H3,(H,37,42)(H,40,41);4-14H,15-16H2,1-3H3,(H,38,43)(H,41,42);4-14,21H,15-16H2,1-3H3,(H,37,42)(H,40,41).
What are the key properties of 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide?
5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide has a molecular weight of 4481.71 g/mol, XLogP of 45.03, 56 rotatable bonds, 14 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-[[3-(difluoromethoxy)-1-pyrimidin-2-ylcyclobutyl]carbamoyl]phenyl]-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-3-fluoro-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-[(3,3-difluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-4-methoxy-2-methylphenyl]-4-fluoro-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;6-[ethyl(methylsulfonyl)amino]-4-fluoro-5-[3-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]phenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[3-fluoro-5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2-methylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;4-fluoro-5-[5-[(3-fluoro-1-pyrimidin-2-ylcyclobutyl)carbamoyl]-2,4-dimethylphenyl]-N-methyl-2-(4-methylphenyl)-1-benzofuran-3-carboxamide is sourced from PubChem (CID 159636948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).