5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide

C188H168F3N29O28S8 — CID 159419601

IUPAC5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cnc(OC)c(-c4cc5n(n4)CCCO5)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5ccncc5s4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5cnc(OC)nc5cn4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5n(n4)CCO5)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4ccc5cc(C(F)(F)F)cnc5n4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4nc5c(s4)C4CCC5C4)c3)cc12
InChIInChI=1S/C33H26F3N5O4S.C32H28N6O5S.C32H30N4O4S2.C31H31N5O6S.C31H26N4O4S2.C29H27N5O5S/c1-18-5-7-19(8-6-18)30-29(32(42)37-2)25-13-24(27(14-28(25)45-30)41(3)46(4,43)44)21-11-22(16-38-15-21)26-10-9-20-12-23(33(34,35)36)17-39-31(20)40-26;1-18-6-8-19(9-7-18)30-29(31(39)33-2)24-12-23(27(13-28(24)43-30)38(3)44(5,40)41)20-10-21(15-34-14-20)25-11-22-16-36-32(42-4)37-26(22)17-35-25;1-17-5-7-18(8-6-17)29-27(31(37)33-2)24-13-23(25(14-26(24)40-29)36(3)42(4,38)39)21-12-22(16-34-15-21)32-35-28-19-9-10-20(11-19)30(28)41-32;1-18-7-9-19(10-8-18)29-28(30(37)32-2)23-14-21(25(16-26(23)42-29)35(3)43(5,38)39)20-13-22(31(40-4)33-17-20)24-15-27-36(34-24)11-6-12-41-27;1-18-5-7-19(8-6-18)30-29(31(36)32-2)24-13-23(25(14-26(24)39-30)35(3)41(4,37)38)21-11-22(16-34-15-21)27-12-20-9-10-33-17-28(20)40-27;1-17-5-7-18(8-6-17)28-27(29(35)30-2)22-12-21(24(14-25(22)39-28)33(3)40(4,36)37)19-11-20(16-31-15-19)23-13-26-34(32-23)9-10-38-26/h5-17H,1-4H3,(H,37,42);6-17H,1-5H3,(H,33,39);5-8,12-16,19-20H,9-11H2,1-4H3,(H,33,37);7-10,13-17H,6,11-12H2,1-5H3,(H,32,37);5-17H,1-4H3,(H,32,36);5-8,11-16H,9-10H2,1-4H3,(H,30,35)
InChIKeyLPPDCVATUIWOSH-UHFFFAOYSA-N
MW3595.12 g/mol
LogP34.67
Rot. Bonds38

About 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide

5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide (PubChem CID 159419601) has the molecular formula C188H168F3N29O28S8 and a molecular weight of 3595.12 g/mol. Its IUPAC name is 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide.

Molecular Properties

Compound Name5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide
PubChem CID159419601
Molecular FormulaC188H168F3N29O28S8
Molecular Weight3595.12 g/mol
Exact Mass3592.03
IUPAC Name5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cnc(OC)c(-c4cc5n(n4)CCCO5)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5ccncc5s4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5cnc(OC)nc5cn4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5n(n4)CCO5)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4ccc5cc(C(F)(F)F)cnc5n4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4nc5c(s4)C4CCC5C4)c3)cc12
InChIInChI=1S/C33H26F3N5O4S.C32H28N6O5S.C32H30N4O4S2.C31H31N5O6S.C31H26N4O4S2.C29H27N5O5S/c1-18-5-7-19(8-6-18)30-29(32(42)37-2)25-13-24(27(14-28(25)45-30)41(3)46(4,43)44)21-11-22(16-38-15-21)26-10-9-20-12-23(33(34,35)36)17-39-31(20)40-26;1-18-6-8-19(9-7-18)30-29(31(39)33-2)24-12-23(27(13-28(24)43-30)38(3)44(5,40)41)20-10-21(15-34-14-20)25-11-22-16-36-32(42-4)37-26(22)17-35-25;1-17-5-7-18(8-6-17)29-27(31(37)33-2)24-13-23(25(14-26(24)40-29)36(3)42(4,38)39)21-12-22(16-34-15-21)32-35-28-19-9-10-20(11-19)30(28)41-32;1-18-7-9-19(10-8-18)29-28(30(37)32-2)23-14-21(25(16-26(23)42-29)35(3)43(5,38)39)20-13-22(31(40-4)33-17-20)24-15-27-36(34-24)11-6-12-41-27;1-18-5-7-19(8-6-18)30-29(31(36)32-2)24-13-23(25(14-26(24)39-30)35(3)41(4,37)38)21-11-22(16-34-15-21)27-12-20-9-10-33-17-28(20)40-27;1-17-5-7-18(8-6-17)28-27(29(35)30-2)22-12-21(24(14-25(22)39-28)33(3)40(4,36)37)19-11-20(16-31-15-19)23-13-26-34(32-23)9-10-38-26/h5-17H,1-4H3,(H,37,42);6-17H,1-5H3,(H,33,39);5-8,12-16,19-20H,9-11H2,1-4H3,(H,33,37);7-10,13-17H,6,11-12H2,1-5H3,(H,32,37);5-17H,1-4H3,(H,32,36);5-8,11-16H,9-10H2,1-4H3,(H,30,35)
InChIKeyLPPDCVATUIWOSH-UHFFFAOYSA-N
XLogP34.67
TPSA717.85 Ų
H-Bond Donors6
H-Bond Acceptors47
Rotatable Bonds38
Heavy Atoms256
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003595.12
LogP ≤ 534.67
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1047

Analyze 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide with MolForge

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Related Compounds

CID 157576784
CID 157576784
N-[5-[5-(4,4-dimethyl-6,7-dihydropyrano[4,3-d][1,3]thiazol-2-yl)-3-pyridinyl]-2-(4-methylphenyl)-3-propanoyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(5-indazol-1-yl-2-methoxy-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(5-indazol-1-yl-6-methoxy-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(5-indazol-1-yl-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-[5-[6-methoxy-5-([1,2,4]triazolo[1,5-a]pyridin-2-yl)-3-pyridinyl]-2-(4-methylphenyl)-3-propanoyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[4-([1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-pyridinyl]-1-benzofuran-3-carboxamide
CID 158490828
5-[6-(1-benzothiophen-2-yl)-3-methoxypyrazin-2-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(1-benzothiophen-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(1-benzothiophen-2-yl)pyridazin-3-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[6-(1-benzothiophen-2-yl)-2-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)-2-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-1-benzofuran-3-carboxamide
CID 158806726
5-[3-(1,3-benzothiazol-2-yl)-4-fluorophenyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[3-(1,3-benzothiazol-2-yl)-4-methoxyphenyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-5-[3-(4-methyl-1,3-benzothiazol-2-yl)phenyl]-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-5-[3-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[3-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]-1-benzofuran-3-carboxamide
CID 158902471
CID 159500408
CID 159500408
5-[5-(6,6-dimethyl-4,7-dihydropyrano[4,3-d][1,3]thiazol-2-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[4-(4-fluoro-1,3-benzothiazol-2-yl)-2-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(6-methoxy-5-thieno[3,2-b]pyridin-2-yl-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(6-methoxy-5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(6-methoxy-5-thieno[3,2-c]pyridin-2-yl-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(6-methoxy-5-thieno[2,3-d]pyrimidin-6-yl-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide
CID 159957764
CID 160719601
CID 160719601
5-[5-(4-fluoro-1,3-benzothiazol-2-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(6-furo[3,2-b]pyridin-2-yl-5-methoxypyrazin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(5-furo[3,2-b]pyridin-2-yl-6-methoxy-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(4-furo[3,2-b]pyridin-2-yl-5-methoxypyrimidin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-(5-furo[3,2-b]pyridin-2-yl-3-pyridinyl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[6-methoxy-5-([1,3]thiazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide
CID 161720368
CID 161842732
CID 161842732
5-[4-(1,3-benzothiazol-2-yl)-6-methoxy-2-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(1,3-benzothiazol-2-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[6-(1,3-benzothiazol-2-yl)-2-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[4-(4-fluoro-1,3-benzothiazol-2-yl)-6-methoxy-2-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(4-fluoro-1,3-benzothiazol-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-1-benzofuran-3-carboxamide
CID 161847032

Frequently Asked Questions

What is the IUPAC name of 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide?
The IUPAC name of 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide (CID 159419601) is 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide.
What is the SMILES notation for 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide?
The canonical SMILES for 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide is CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cnc(OC)c(-c4cc5n(n4)CCCO5)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5ccncc5s4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5cnc(OC)nc5cn4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4cc5n(n4)CCO5)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4ccc5cc(C(F)(F)F)cnc5n4)c3)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2cc(N(C)S(C)(=O)=O)c(-c3cncc(-c4nc5c(s4)C4CCC5C4)c3)cc12.
What is the InChIKey of 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide?
The InChIKey is LPPDCVATUIWOSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26F3N5O4S.C32H28N6O5S.C32H30N4O4S2.C31H31N5O6S.C31H26N4O4S2.C29H27N5O5S/c1-18-5-7-19(8-6-18)30-29(32(42)37-2)25-13-24(27(14-28(25)45-30)41(3)46(4,43)44)21-11-22(16-38-15-21)26-10-9-20-12-23(33(34,35)36)17-39-31(20)40-26;1-18-6-8-19(9-7-18)30-29(31(39)33-2)24-12-23(27(13-28(24)43-30)38(3)44(5,40)41)20-10-21(15-34-14-20)25-11-22-16-36-32(42-4)37-26(22)17-35-25;1-17-5-7-18(8-6-17)29-27(31(37)33-2)24-13-23(25(14-26(24)40-29)36(3)42(4,38)39)21-12-22(16-34-15-21)32-35-28-19-9-10-20(11-19)30(28)41-32;1-18-7-9-19(10-8-18)29-28(30(37)32-2)23-14-21(25(16-26(23)42-29)35(3)43(5,38)39)20-13-22(31(40-4)33-17-20)24-15-27-36(34-24)11-6-12-41-27;1-18-5-7-19(8-6-18)30-29(31(36)32-2)24-13-23(25(14-26(24)39-30)35(3)41(4,37)38)21-11-22(16-34-15-21)27-12-20-9-10-33-17-28(20)40-27;1-17-5-7-18(8-6-17)28-27(29(35)30-2)22-12-21(24(14-25(22)39-28)33(3)40(4,36)37)19-11-20(16-31-15-19)23-13-26-34(32-23)9-10-38-26/h5-17H,1-4H3,(H,37,42);6-17H,1-5H3,(H,33,39);5-8,12-16,19-20H,9-11H2,1-4H3,(H,33,37);7-10,13-17H,6,11-12H2,1-5H3,(H,32,37);5-17H,1-4H3,(H,32,36);5-8,11-16H,9-10H2,1-4H3,(H,30,35).
What are the key properties of 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide?
5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide has a molecular weight of 3595.12 g/mol, XLogP of 34.67, 38 rotatable bonds, 6 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(2-methoxypyrido[3,4-d]pyrimidin-6-yl)-3-pyridinyl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-(3-thia-5-azatricyclo[5.2.1.02,6]deca-2(6),4-dien-4-yl)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-(5-thieno[2,3-c]pyridin-2-yl-3-pyridinyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-[6-(trifluoromethyl)-1,8-naphthyridin-2-yl]-3-pyridinyl]-1-benzofuran-3-carboxamide is sourced from PubChem (CID 159419601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).