[7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone

C139H129Cl6N19O16S3 — CID 158218682

IUPAC[7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone
SMILESCN1CCC(=O)N(Cc2cc3nccc(-c4cc(Cl)cc5c4OC(C(=O)N4CCCCC4)C5)c3s2)C1=O.N#Cc1cc2nccc(-c3cc(Cl)cc4c3OC(C(=O)N3CCCCC3)C4)c2o1.N#Cc1cc2nccc(-c3cc(Cl)cc4c3OC(C(=O)N3CCCCC3)C4)c2s1.O=C(C1Cc2cc(Cl)cc(-c3ccnc(Nc4ccccc4)c3)c2O1)N1CCCCC1.O=C(C1Cc2cc(Cl)cc(-c3ccnc4cc(CCO)sc34)c2O1)N1CCCCC1.O=C(C1Cc2cc(Cl)cc(-c3ccnc4ccnn34)c2O1)N1CCCCC1
InChIInChI=1S/C27H27ClN4O4S.C25H24ClN3O2.C23H23ClN2O3S.C22H18ClN3O3.C22H18ClN3O2S.C20H19ClN4O2/c1-30-10-6-23(33)32(27(30)35)15-18-14-21-25(37-18)19(5-7-29-21)20-13-17(28)11-16-12-22(36-24(16)20)26(34)31-8-3-2-4-9-31;26-19-13-18-14-22(25(30)29-11-5-2-6-12-29)31-24(18)21(16-19)17-9-10-27-23(15-17)28-20-7-3-1-4-8-20;24-15-10-14-11-20(23(28)26-7-2-1-3-8-26)29-21(14)18(12-15)17-4-6-25-19-13-16(5-9-27)30-22(17)19;23-14-8-13-9-19(22(27)26-6-2-1-3-7-26)29-20(13)17(10-14)16-4-5-25-18-11-15(12-24)28-21(16)18;23-14-8-13-9-19(22(27)26-6-2-1-3-7-26)28-20(13)17(10-14)16-4-5-25-18-11-15(12-24)29-21(16)18;21-14-10-13-11-17(20(26)24-8-2-1-3-9-24)27-19(13)15(12-14)16-4-6-22-18-5-7-23-25(16)18/h5,7,11,13-14,22H,2-4,6,8-10,12,15H2,1H3;1,3-4,7-10,13,15-16,22H,2,5-6,11-12,14H2,(H,27,28);4,6,10,12-13,20,27H,1-3,5,7-9,11H2;2*4-5,8,10-11,19H,1-3,6-7,9H2;4-7,10,12,17H,1-3,8-9,11H2
InChIKeyGCZALGBZBXTROU-UHFFFAOYSA-N
MW2630.60 g/mol
LogP27.15
Rot. Bonds18

About [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone

[7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone (PubChem CID 158218682) has the molecular formula C139H129Cl6N19O16S3 and a molecular weight of 2630.60 g/mol. Its IUPAC name is [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone
PubChem CID158218682
Molecular FormulaC139H129Cl6N19O16S3
Molecular Weight2630.60 g/mol
Exact Mass2625.72
IUPAC Name[7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone
SMILESCN1CCC(=O)N(Cc2cc3nccc(-c4cc(Cl)cc5c4OC(C(=O)N4CCCCC4)C5)c3s2)C1=O.N#Cc1cc2nccc(-c3cc(Cl)cc4c3OC(C(=O)N3CCCCC3)C4)c2o1.N#Cc1cc2nccc(-c3cc(Cl)cc4c3OC(C(=O)N3CCCCC3)C4)c2s1.O=C(C1Cc2cc(Cl)cc(-c3ccnc(Nc4ccccc4)c3)c2O1)N1CCCCC1.O=C(C1Cc2cc(Cl)cc(-c3ccnc4cc(CCO)sc34)c2O1)N1CCCCC1.O=C(C1Cc2cc(Cl)cc(-c3ccnc4ccnn34)c2O1)N1CCCCC1
InChIInChI=1S/C27H27ClN4O4S.C25H24ClN3O2.C23H23ClN2O3S.C22H18ClN3O3.C22H18ClN3O2S.C20H19ClN4O2/c1-30-10-6-23(33)32(27(30)35)15-18-14-21-25(37-18)19(5-7-29-21)20-13-17(28)11-16-12-22(36-24(16)20)26(34)31-8-3-2-4-9-31;26-19-13-18-14-22(25(30)29-11-5-2-6-12-29)31-24(18)21(16-19)17-9-10-27-23(15-17)28-20-7-3-1-4-8-20;24-15-10-14-11-20(23(28)26-7-2-1-3-8-26)29-21(14)18(12-15)17-4-6-25-19-13-16(5-9-27)30-22(17)19;23-14-8-13-9-19(22(27)26-6-2-1-3-7-26)29-20(13)17(10-14)16-4-5-25-18-11-15(12-24)28-21(16)18;23-14-8-13-9-19(22(27)26-6-2-1-3-7-26)28-20(13)17(10-14)16-4-5-25-18-11-15(12-24)29-21(16)18;21-14-10-13-11-17(20(26)24-8-2-1-3-9-24)27-19(13)15(12-14)16-4-6-22-18-5-7-23-25(16)18/h5,7,11,13-14,22H,2-4,6,8-10,12,15H2,1H3;1,3-4,7-10,13,15-16,22H,2,5-6,11-12,14H2,(H,27,28);4,6,10,12-13,20,27H,1-3,5,7-9,11H2;2*4-5,8,10-11,19H,1-3,6-7,9H2;4-7,10,12,17H,1-3,8-9,11H2
InChIKeyGCZALGBZBXTROU-UHFFFAOYSA-N
XLogP27.15
TPSA405.48 Ų
H-Bond Donors2
H-Bond Acceptors30
Rotatable Bonds18
Heavy Atoms183
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002630.60
LogP ≤ 527.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1030

Analyze [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone with MolForge

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Launch Full Analysis

Related Compounds

CID 158108097
CID 158108097
[7-[5-chloro-2-[5-(dimethylamino)-4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl]-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methanol;[5-chloro-7-[2-(hydroxymethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-[2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl]methanone;[5-chloro-7-[2-(1-hydroxypropyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-[4-(3H-pyrrol-4-yl)piperidin-1-yl]methanone;1-[7-[5-chloro-2-[4-(piperidin-1-ylmethyl)-1,3-oxazol-5-yl]-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]propan-1-ol;7-[2-(hydroxymethyl)thieno[3,2-b]pyridin-7-yl]-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-5-carbonitrile
CID 160109617
1-[4-[5-chloro-2-[4-[(2,2-difluoropropylamino)methyl]-1,3-oxazol-5-yl]-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;1-[4-[5-chloro-2-[5-(dimethylamino)-2-methyl-4,5,6,7-tetrahydroindazol-3-yl]-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[5-chloro-7-[2-(hydroxymethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-(3-hydroxypyrrolidin-1-yl)methanone;[5-chloro-7-[7-(1-hydroxypropyl)quinolin-4-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;1-[7-[5-chloro-2-methyl-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-3H-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]propan-1-ol;[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]pyrazolo[1,5-a]pyrimidin-2-yl]methanol
CID 160362646
CID 160605305
CID 160605305
1-[4-[5-chloro-2-[4-[(2,2-difluoropropylamino)methyl]-1,3-oxazol-5-yl]-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[5-chloro-7-[2-(hydroxymethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-(3-hydroxypyrrolidin-1-yl)methanone;1-[7-[5-chloro-2-(piperidin-1-ylmethyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]propan-1-ol;3-[4-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]-6,7-dihydro-5H-cyclopenta[b]pyridin-6-yl]pentan-3-ol;[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]-2,3-dihydrofuro[3,2-b]pyridin-2-yl]methanol;1-[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]pyrazolo[1,5-a]pyrimidin-2-yl]propan-1-ol
CID 160775088
1-[4-[5-chloro-2-[4-[(2,2-difluoropropylamino)methyl]-1,3-oxazol-5-yl]-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;1-[7-[5-chloro-2-(piperidin-1-ylmethyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]propan-1-ol;3-[4-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]-6,7-dihydro-5H-cyclopenta[b]pyridin-6-yl]pentan-3-ol;2-[4-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]-6,7-dihydro-5H-cyclopenta[b]pyridin-6-yl]propan-2-ol;[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]-2,3-dihydrofuro[3,2-b]pyridin-2-yl]methanol;1-[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]pyrazolo[1,5-a]pyrimidin-2-yl]propan-1-ol
CID 161972673
bis(1-[[4-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]-6,7-dihydro-5H-cyclopenta[b]pyridin-6-yl]methyl]pyrrolidine-2,5-dione);1-[[4-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-d]pyrimidin-6-yl]methyl]pyrrolidine-2,5-dione;1-[1-[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]ethyl]pyrrolidine-2,5-dione;1-[2-[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]ethyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]pyrazolo[1,5-a]pyrimidin-2-yl]methyl]pyrrolidine-2,5-dione
CID 157090588
1-[4-[5-chloro-2-[5-(dimethylamino)-2-methyl-4,5,6,7-tetrahydroindazol-3-yl]-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[5-chloro-7-[7-(1-hydroxypropyl)quinolin-4-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(1-hydroxypropyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-[4-(3H-pyrrol-4-yl)piperidin-1-yl]methanone;1-[7-[5-chloro-2-methyl-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-3H-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]propan-1-ol;[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]pyrazolo[1,5-a]pyrimidin-2-yl]methanol
CID 157118201
1-[7-[5-chloro-2-(5-methyl-6,7-dihydro-4H-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]propan-1-ol;[5-chloro-7-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2,3-dihydro-1-benzofuran-2-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;1-[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridin-2-yl]propan-1-ol;1-[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]propan-1-ol
CID 157203026
[5-chloro-7-[6-(hydroxymethyl)-6-propyl-5,7-dihydrocyclopenta[b]pyridin-4-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(hydroxymethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[5-chloro-7-[2-(hydroxymethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)methanone;1-[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridin-2-yl]propan-1-ol;1-[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]propan-1-ol
CID 157461271
2-[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]-2-hydroxy-N,N-dimethylbutanamide;3-[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]-N-methylpropanamide;3-[5-chloro-7-[2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridine;4-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]-6-methylfuro[3,2-d]pyrimidine;N-[[4-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-d]pyrimidin-6-yl]methyl]acetamide;4-[5-chloro-2-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]quinoline-7-carbonitrile
CID 157500209
1-[[4-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]-6,7-dihydro-5H-cyclopenta[b]pyridin-6-yl]methyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-d]pyrimidin-6-yl]methyl]pyrrolidine-2,5-dione;1-[1-[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]ethyl]pyrrolidine-2,5-dione;1-[2-[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]ethyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]pyrazolo[1,5-a]pyrimidin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-2-(4,5,6,7-tetrahydro-[1,2]oxazolo[4,3-c]pyridin-3-yl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidin-2-one
CID 157543791

Frequently Asked Questions

What is the IUPAC name of [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone?
The IUPAC name of [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone (CID 158218682) is [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone?
The canonical SMILES for [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone is CN1CCC(=O)N(Cc2cc3nccc(-c4cc(Cl)cc5c4OC(C(=O)N4CCCCC4)C5)c3s2)C1=O.N#Cc1cc2nccc(-c3cc(Cl)cc4c3OC(C(=O)N3CCCCC3)C4)c2o1.N#Cc1cc2nccc(-c3cc(Cl)cc4c3OC(C(=O)N3CCCCC3)C4)c2s1.O=C(C1Cc2cc(Cl)cc(-c3ccnc(Nc4ccccc4)c3)c2O1)N1CCCCC1.O=C(C1Cc2cc(Cl)cc(-c3ccnc4cc(CCO)sc34)c2O1)N1CCCCC1.O=C(C1Cc2cc(Cl)cc(-c3ccnc4ccnn34)c2O1)N1CCCCC1.
What is the InChIKey of [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone?
The InChIKey is GCZALGBZBXTROU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27ClN4O4S.C25H24ClN3O2.C23H23ClN2O3S.C22H18ClN3O3.C22H18ClN3O2S.C20H19ClN4O2/c1-30-10-6-23(33)32(27(30)35)15-18-14-21-25(37-18)19(5-7-29-21)20-13-17(28)11-16-12-22(36-24(16)20)26(34)31-8-3-2-4-9-31;26-19-13-18-14-22(25(30)29-11-5-2-6-12-29)31-24(18)21(16-19)17-9-10-27-23(15-17)28-20-7-3-1-4-8-20;24-15-10-14-11-20(23(28)26-7-2-1-3-8-26)29-21(14)18(12-15)17-4-6-25-19-13-16(5-9-27)30-22(17)19;23-14-8-13-9-19(22(27)26-6-2-1-3-7-26)29-20(13)17(10-14)16-4-5-25-18-11-15(12-24)28-21(16)18;23-14-8-13-9-19(22(27)26-6-2-1-3-7-26)28-20(13)17(10-14)16-4-5-25-18-11-15(12-24)29-21(16)18;21-14-10-13-11-17(20(26)24-8-2-1-3-9-24)27-19(13)15(12-14)16-4-6-22-18-5-7-23-25(16)18/h5,7,11,13-14,22H,2-4,6,8-10,12,15H2,1H3;1,3-4,7-10,13,15-16,22H,2,5-6,11-12,14H2,(H,27,28);4,6,10,12-13,20,27H,1-3,5,7-9,11H2;2*4-5,8,10-11,19H,1-3,6-7,9H2;4-7,10,12,17H,1-3,8-9,11H2.
What are the key properties of [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone?
[7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone has a molecular weight of 2630.60 g/mol, XLogP of 27.15, 18 rotatable bonds, 2 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for [7-(2-anilino-4-pyridinyl)-5-chloro-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;[5-chloro-7-[2-(2-hydroxyethyl)thieno[3,2-b]pyridin-7-yl]-2,3-dihydro-1-benzofuran-2-yl]-piperidin-1-ylmethanone;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]furo[3,2-b]pyridine-2-carbonitrile;7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridine-2-carbonitrile;3-[[7-[5-chloro-2-(piperidine-1-carbonyl)-2,3-dihydro-1-benzofuran-7-yl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methyl-1,3-diazinane-2,4-dione;(5-chloro-7-pyrazolo[1,5-a]pyrimidin-7-yl-2,3-dihydro-1-benzofuran-2-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 158218682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).