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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide

C121H117N15O17S10 — CID 91356337

IUPACN,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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide
SMILESCC[C@@H]1CCCN1C(=O)c1cc2nccc(Oc3ccc4c(C(=O)NC)c(C)sc4c3)c2s1.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CCC[C@H]5CO)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](O)C5)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5C[C@@H](C)[C@@H](C)C5)sc34)ccc12
InChIInChI=1S/2C25H25N3O3S2.C24H23N3O4S2.C24H23N3O3S2.C23H21N3O4S2/c1-13-11-28(12-14(13)2)25(30)21-10-18-23(33-21)19(7-8-27-18)31-16-5-6-17-20(9-16)32-15(3)22(17)24(29)26-4;1-4-15-6-5-11-28(15)25(30)21-13-18-23(33-21)19(9-10-27-18)31-16-7-8-17-20(12-16)32-14(2)22(17)24(29)26-3;1-13-21(23(29)25-2)16-6-5-15(10-19(16)32-13)31-18-7-8-26-17-11-20(33-22(17)18)24(30)27-9-3-4-14(27)12-28;1-13-7-9-27(12-13)24(29)20-11-17-22(32-20)18(6-8-26-17)30-15-4-5-16-19(10-15)31-14(2)21(16)23(28)25-3;1-12-20(22(28)24-2)15-4-3-14(9-18(15)31-12)30-17-5-7-25-16-10-19(32-21(16)17)23(29)26-8-6-13(27)11-26/h5-10,13-14H,11-12H2,1-4H3,(H,26,29);7-10,12-13,15H,4-6,11H2,1-3H3,(H,26,29);5-8,10-11,14,28H,3-4,9,12H2,1-2H3,(H,25,29);4-6,8,10-11,13H,7,9,12H2,1-3H3,(H,25,28);3-5,7,9-10,13,27H,6,8,11H2,1-2H3,(H,24,28)/t13-,14+;15-;14-;2*13-/m.1011/s1
InChIKeyMMQGPHDNXVCUMG-CFLZATOCSA-N
MW2374.02 g/mol
LogP25.88
Rot. Bonds22

About 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide (PubChem CID 91356337) has the molecular formula C121H117N15O17S10 and a molecular weight of 2374.02 g/mol. Its IUPAC name is 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide.

Molecular Properties

Compound NameN,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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide
PubChem CID91356337
Molecular FormulaC121H117N15O17S10
Molecular Weight2374.02 g/mol
Exact Mass2371.60
IUPAC NameN,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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide
SMILESCC[C@@H]1CCCN1C(=O)c1cc2nccc(Oc3ccc4c(C(=O)NC)c(C)sc4c3)c2s1.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CCC[C@H]5CO)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](O)C5)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5C[C@@H](C)[C@@H](C)C5)sc34)ccc12
InChIInChI=1S/2C25H25N3O3S2.C24H23N3O4S2.C24H23N3O3S2.C23H21N3O4S2/c1-13-11-28(12-14(13)2)25(30)21-10-18-23(33-21)19(7-8-27-18)31-16-5-6-17-20(9-16)32-15(3)22(17)24(29)26-4;1-4-15-6-5-11-28(15)25(30)21-13-18-23(33-21)19(9-10-27-18)31-16-7-8-17-20(12-16)32-14(2)22(17)24(29)26-3;1-13-21(23(29)25-2)16-6-5-15(10-19(16)32-13)31-18-7-8-26-17-11-20(33-22(17)18)24(30)27-9-3-4-14(27)12-28;1-13-7-9-27(12-13)24(29)20-11-17-22(32-20)18(6-8-26-17)30-15-4-5-16-19(10-15)31-14(2)21(16)23(28)25-3;1-12-20(22(28)24-2)15-4-3-14(9-18(15)31-12)30-17-5-7-25-16-10-19(32-21(16)17)23(29)26-8-6-13(27)11-26/h5-10,13-14H,11-12H2,1-4H3,(H,26,29);7-10,12-13,15H,4-6,11H2,1-3H3,(H,26,29);5-8,10-11,14,28H,3-4,9,12H2,1-2H3,(H,25,29);4-6,8,10-11,13H,7,9,12H2,1-3H3,(H,25,28);3-5,7,9-10,13,27H,6,8,11H2,1-2H3,(H,24,28)/t13-,14+;15-;14-;2*13-/m.1011/s1
InChIKeyMMQGPHDNXVCUMG-CFLZATOCSA-N
XLogP25.88
TPSA398.11 Ų
H-Bond Donors7
H-Bond Acceptors32
Rotatable Bonds22
Heavy Atoms163
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002374.02
LogP ≤ 525.88
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1032

Analyze 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide with MolForge

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Related Compounds

N-cyclopropyl-6-[2-[2-(hydroxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-2-methyl-1-benzothiophene-3-carboxamide
CID 10436267
6-[(2-{[(3R)-3-Methoxypyrrolidin-1-yl]carbonyl}thieno[3,2-b]pyridin-7-yl)oxy]-2-methyl benzo[b]thiophene-3-carboxylic acid 3-hydroxypropylamide
CID 59990759
6-[2-[(2S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,N,2-trimethyl-1-benzothiophene-3-carboxamide
CID 59990774
6-(2-[(S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yloxy)-2-methylbenzo[b]thiophene-3-carboxylic acid methylamide
CID 59990783
6-[(2-{[(2S)-2-(Methoxymethyl)pyrrolidin-1-yl]carbonyl}thieno[3,2-b]pyridin-7-yl)oxy]-2-methylbenzo[b]thiophene-3-carboxylic acid 3-hydroxypropylamide
CID 59990785
6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,N,2-trimethyl-1-benzothiophene-3-carboxamide
CID 59990787
6-(2-[(S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yloxy)-2-methylbenzo[b]thiophene-3-carboxylic acid cyclopropylamide
CID 59990791
6-[(2-{[(3R)-3-Methoxypyrrolidin-1-yl]carbonyl}thieno[3,2-b]pyridin-7-yl)oxy]-2-methyl benzo[b]thiophene-3-carboxylic acid 2-hydroxyethylamide
CID 59990792
6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide
CID 59990793
6[(2-{[(3R)-3-Hydroxypyrrolidin-1-yl]carbonyl}thieno[3,2-b]pyridin-7-yl)oxy]-2-methylbenzo[b]thiophene-3-carboxylic acid (cyclopropylmethyl)amide
CID 59990806
2-Ethyl-6-[(2-{[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]carbonyl)thieno[3,2-b]pyridin-7-yl)oxy]benzo[b]thiophene-3-carboxylic acid methylamide
CID 59990807
6-[(2-{[(3R)-3-Hydroxypyrrolidin-1-yl]carbonyl}thieno[3,2-b]pyridin-7-yl)oxy]-2-methyl benzo[b]thiophene-3-carboxylic acid cyclopropylamide
CID 59990817

Frequently Asked Questions

What is the IUPAC name of 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide?
The IUPAC name of 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide (CID 91356337) is 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide.
What is the SMILES notation for 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide?
The canonical SMILES for 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide is CC[C@@H]1CCCN1C(=O)c1cc2nccc(Oc3ccc4c(C(=O)NC)c(C)sc4c3)c2s1.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CCC[C@H]5CO)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](C)C5)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5CC[C@@H](O)C5)sc34)ccc12.CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(C(=O)N5C[C@@H](C)[C@@H](C)C5)sc34)ccc12.
What is the InChIKey of 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide?
The InChIKey is MMQGPHDNXVCUMG-CFLZATOCSA-N. The full InChI is InChI=1S/2C25H25N3O3S2.C24H23N3O4S2.C24H23N3O3S2.C23H21N3O4S2/c1-13-11-28(12-14(13)2)25(30)21-10-18-23(33-21)19(7-8-27-18)31-16-5-6-17-20(9-16)32-15(3)22(17)24(29)26-4;1-4-15-6-5-11-28(15)25(30)21-13-18-23(33-21)19(9-10-27-18)31-16-7-8-17-20(12-16)32-14(2)22(17)24(29)26-3;1-13-21(23(29)25-2)16-6-5-15(10-19(16)32-13)31-18-7-8-26-17-11-20(33-22(17)18)24(30)27-9-3-4-14(27)12-28;1-13-7-9-27(12-13)24(29)20-11-17-22(32-20)18(6-8-26-17)30-15-4-5-16-19(10-15)31-14(2)21(16)23(28)25-3;1-12-20(22(28)24-2)15-4-3-14(9-18(15)31-12)30-17-5-7-25-16-10-19(32-21(16)17)23(29)26-8-6-13(27)11-26/h5-10,13-14H,11-12H2,1-4H3,(H,26,29);7-10,12-13,15H,4-6,11H2,1-3H3,(H,26,29);5-8,10-11,14,28H,3-4,9,12H2,1-2H3,(H,25,29);4-6,8,10-11,13H,7,9,12H2,1-3H3,(H,25,28);3-5,7,9-10,13,27H,6,8,11H2,1-2H3,(H,24,28)/t13-,14+;15-;14-;2*13-/m.1011/s1.
What are the key properties of 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide has a molecular weight of 2374.02 g/mol, XLogP of 25.88, 22 rotatable bonds, 7 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 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;6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-N,2-dimethyl-1-benzothiophene-3-carboxamide is sourced from PubChem (CID 91356337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).