N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide

C125H122N16O18S6 — CID 157355635

IUPACN-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide
SMILESCCc1oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)NC.CNC(=O)c1c(C(C)C)oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc12.Cc1oc2cc(Oc3ccnc4cc(-c5nccn5C)sc34)ccc2c1C(=O)N(C)C.Cc1oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)N(C)C.Cc1sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)NC1CC1
InChIInChI=1S/C26H27N3O4S.C26H25N3O3S2.2C25H25N3O4S.C23H20N4O3S/c1-14(2)23-22(25(30)27-4)17-6-5-16(11-20(17)33-23)32-19-7-9-28-18-12-21(34-24(18)19)26(31)29-10-8-15(3)13-29;1-14-8-10-29(13-14)26(31)22-12-19-24(34-22)20(7-9-27-19)32-17-5-6-18-21(11-17)33-15(2)23(18)25(30)28-16-3-4-16;1-14-8-10-28(13-14)24(29)21-12-18-23(33-21)19(7-9-26-18)32-16-5-6-17-20(11-16)31-15(2)22(17)25(30)27(3)4;1-4-18-22(24(29)26-3)16-6-5-15(11-20(16)32-18)31-19-7-9-27-17-12-21(33-23(17)19)25(30)28-10-8-14(2)13-28;1-13-20(23(28)26(2)3)15-6-5-14(11-18(15)29-13)30-17-7-8-24-16-12-19(31-21(16)17)22-25-9-10-27(22)4/h5-7,9,11-12,14-15H,8,10,13H2,1-4H3,(H,27,30);5-7,9,11-12,14,16H,3-4,8,10,13H2,1-2H3,(H,28,30);5-7,9,11-12,14H,8,10,13H2,1-4H3;5-7,9,11-12,14H,4,8,10,13H2,1-3H3,(H,26,29);5-12H,1-4H3/t15-;3*14-;/m1111./s1
InChIKeyBIAXRVLOSNRKDO-YGXDPCQCSA-N
MW2328.85 g/mol
LogP27.60
Rot. Bonds23

About N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide

N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide (PubChem CID 157355635) has the molecular formula C125H122N16O18S6 and a molecular weight of 2328.85 g/mol. Its IUPAC name is N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide
PubChem CID157355635
Molecular FormulaC125H122N16O18S6
Molecular Weight2328.85 g/mol
Exact Mass2326.74
IUPAC NameN-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide
SMILESCCc1oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)NC.CNC(=O)c1c(C(C)C)oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc12.Cc1oc2cc(Oc3ccnc4cc(-c5nccn5C)sc34)ccc2c1C(=O)N(C)C.Cc1oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)N(C)C.Cc1sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)NC1CC1
InChIInChI=1S/C26H27N3O4S.C26H25N3O3S2.2C25H25N3O4S.C23H20N4O3S/c1-14(2)23-22(25(30)27-4)17-6-5-16(11-20(17)33-23)32-19-7-9-28-18-12-21(34-24(18)19)26(31)29-10-8-15(3)13-29;1-14-8-10-29(13-14)26(31)22-12-19-24(34-22)20(7-9-27-19)32-17-5-6-18-21(11-17)33-15(2)23(18)25(30)28-16-3-4-16;1-14-8-10-28(13-14)24(29)21-12-18-23(33-21)19(7-9-26-18)32-16-5-6-17-20(11-16)31-15(2)22(17)25(30)27(3)4;1-4-18-22(24(29)26-3)16-6-5-15(11-20(16)32-18)31-19-7-9-27-17-12-21(33-23(17)19)25(30)28-10-8-14(2)13-28;1-13-20(23(28)26(2)3)15-6-5-14(11-18(15)29-13)30-17-7-8-24-16-12-19(31-21(16)17)22-25-9-10-27(22)4/h5-7,9,11-12,14-15H,8,10,13H2,1-4H3,(H,27,30);5-7,9,11-12,14,16H,3-4,8,10,13H2,1-2H3,(H,28,30);5-7,9,11-12,14H,8,10,13H2,1-4H3;5-7,9,11-12,14H,4,8,10,13H2,1-3H3,(H,26,29);5-12H,1-4H3/t15-;3*14-;/m1111./s1
InChIKeyBIAXRVLOSNRKDO-YGXDPCQCSA-N
XLogP27.60
TPSA390.14 Ų
H-Bond Donors3
H-Bond Acceptors31
Rotatable Bonds23
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002328.85
LogP ≤ 527.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1031

Analyze N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide with MolForge

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Related Compounds

N,2-dimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide
CID 10387284
2-Ethyl-6-[2-(1-methyl-1H-imidazol-2-yl)-thieno[3,2-b]pyridin-7-yloxy]-benzofuran-3-carboxylic acid methylamide
CID 20767797
2-Methyl-6-[2-(1-methyl-1H-imidazol-2-yl)-thieno[3,2-b]pyridin-7-yloxy]-benzofuran-3-carboxylic acid isobutyl amide
CID 20767924
2-Methyl-6-[2-(1-methyl-1H-imidazol-2-yl)-thieno[3,2-b]pyridin-7-yloxy]-benzofuran-3-carboxylic acid isopropyl amide
CID 20767930
N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide
CID 20767935
2-methyl-[2-(1-methyl-1H-imidazol-2-yl)thieno[3,2-b]pyridin-7-yloxy]-benzofuran-3-carboxylic acid methylamide
CID 69596812
N,2-dimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;N,2-dimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;6-[2-[(3R,4S)-3,4-dimethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide;6-[2-[(2R)-2-ethylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide;6-[2-[(2S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide
CID 91365551
N-cyclopropyl-6-[2-[(2S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-methyl-1-benzothiophene-3-carboxamide;6-[2-[(3R,4S)-3,4-dihydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,N,2-trimethyl-1-benzothiophene-3-carboxamide;6-[2-[(3R,4S)-3,4-dimethoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,N,2-trimethyl-1-benzothiophene-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide
CID 157358368
24-[2,6-Diphenyl-4-(2-phenyl-[1]benzothiolo[3,2-d]pyrimidin-4-yl)phenyl]-6,15-dioxa-24-azaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene;24-[2,6-diphenyl-4-(2-phenyl-[1]benzothiolo[3,2-d]pyrimidin-4-yl)phenyl]-15-oxa-6-thia-24-azaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene;6-[2,6-diphenyl-4-(2-phenyl-[1]benzothiolo[3,2-d]pyrimidin-4-yl)phenyl]-24-phenyl-15-thia-6,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene;5-[4-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-11-phenyl-[1]benzofuro[3,2-c]carbazole
CID 157750943
N-cyclopropyl-6-[7-(1-methylimidazol-4-yl)quinolin-4-yl]oxy-1-benzofuran-3-carboxamide;N-ethyl-6-[7-(1-methylimidazol-4-yl)quinolin-4-yl]oxy-1-benzofuran-3-carboxamide;6-[7-(1-methylimidazol-4-yl)quinolin-4-yl]oxy-N-(trideuteriomethyl)-1-benzofuran-3-carboxamide;N-methyl-6-[7-(1-methylimidazol-4-yl)quinolin-4-yl]oxy-1-benzofuran-3-carboxamide
CID 157996726
N-cyclopropyl-1,2-dimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxyindole-3-carboxamide;6-[2-[(2S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,N,1,2-tetramethylindole-3-carboxamide;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,N,1,2-tetramethylindole-3-carboxamide;N,N,1,2-tetramethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxyindole-3-carboxamide;N,N,1,2-tetramethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxyindole-3-carboxamide
CID 158080628
N-cyclopropyl-6-[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-methyl-1-benzothiophene-3-carboxamide;6-[2-(3-hydroxyazetidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-N,N,2-trimethyl-1-benzothiophene-3-carboxamide;6-[2-[(3R)-3-methoxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,N,2-trimethyl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(2-methylpyrazol-3-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide
CID 158127635

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide?
The IUPAC name of N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide (CID 157355635) is N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide?
The canonical SMILES for N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide is CCc1oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)NC.CNC(=O)c1c(C(C)C)oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc12.Cc1oc2cc(Oc3ccnc4cc(-c5nccn5C)sc34)ccc2c1C(=O)N(C)C.Cc1oc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)N(C)C.Cc1sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc2c1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide?
The InChIKey is BIAXRVLOSNRKDO-YGXDPCQCSA-N. The full InChI is InChI=1S/C26H27N3O4S.C26H25N3O3S2.2C25H25N3O4S.C23H20N4O3S/c1-14(2)23-22(25(30)27-4)17-6-5-16(11-20(17)33-23)32-19-7-9-28-18-12-21(34-24(18)19)26(31)29-10-8-15(3)13-29;1-14-8-10-29(13-14)26(31)22-12-19-24(34-22)20(7-9-27-19)32-17-5-6-18-21(11-17)33-15(2)23(18)25(30)28-16-3-4-16;1-14-8-10-28(13-14)24(29)21-12-18-23(33-21)19(7-9-26-18)32-16-5-6-17-20(11-16)31-15(2)22(17)25(30)27(3)4;1-4-18-22(24(29)26-3)16-6-5-15(11-20(16)32-18)31-19-7-9-27-17-12-21(33-23(17)19)25(30)28-10-8-14(2)13-28;1-13-20(23(28)26(2)3)15-6-5-14(11-18(15)29-13)30-17-7-8-24-16-12-19(31-21(16)17)22-25-9-10-27(22)4/h5-7,9,11-12,14-15H,8,10,13H2,1-4H3,(H,27,30);5-7,9,11-12,14,16H,3-4,8,10,13H2,1-2H3,(H,28,30);5-7,9,11-12,14H,8,10,13H2,1-4H3;5-7,9,11-12,14H,4,8,10,13H2,1-3H3,(H,26,29);5-12H,1-4H3/t15-;3*14-;/m1111./s1.
What are the key properties of N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide?
N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide has a molecular weight of 2328.85 g/mol, XLogP of 27.60, 23 rotatable bonds, 3 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxamide;2-ethyl-N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N-methyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-(1-methylimidazol-2-yl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide;N,N,2-trimethyl-6-[2-[(3R)-3-methylpyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-benzofuran-3-carboxamide is sourced from PubChem (CID 157355635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).