(4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol

C97H72Cl5N17O5S6 — CID 161386663

IUPAC(4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol
SMILESCCc1cc(-c2cc(C(O)c3ccc(Cl)cc3)c(-c3ncc[nH]3)s2)ccn1.OC(c1ccc(Cl)cc1)c1cc(-c2ccnc3sccc23)sc1-c1ncc[nH]1.OC(c1ccc(Cl)cc1)c1cc(-c2ccncc2)sc1-c1ncc[nH]1.O[C@@H](c1ccc(Cl)cc1)c1cc(-c2ccnnc2)sc1-c1ncc[nH]1.O[C@H](c1ccc(Cl)cc1)c1cc(-c2ccnnc2)sc1-c1ncc[nH]1
InChIInChI=1S/C21H14ClN3OS2.C21H18ClN3OS.C19H14ClN3OS.2C18H13ClN4OS/c22-13-3-1-12(2-4-13)18(26)16-11-17(28-19(16)20-23-8-9-24-20)14-5-7-25-21-15(14)6-10-27-21;1-2-16-11-14(7-8-23-16)18-12-17(20(27-18)21-24-9-10-25-21)19(26)13-3-5-15(22)6-4-13;20-14-3-1-13(2-4-14)17(24)15-11-16(12-5-7-21-8-6-12)25-18(15)19-22-9-10-23-19;2*19-13-3-1-11(2-4-13)16(24)14-9-15(12-5-6-22-23-10-12)25-17(14)18-20-7-8-21-18/h1-11,18,26H,(H,23,24);3-12,19,26H,2H2,1H3,(H,24,25);1-11,17,24H,(H,22,23);2*1-10,16,24H,(H,20,21)/t;;;2*16-/m...10/s1
InChIKeyVSLBLYLGKZXKKK-JGBMOPGWSA-N
MW1925.42 g/mol
LogP25.24
Rot. Bonds21

About (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol

(4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol (PubChem CID 161386663) has the molecular formula C97H72Cl5N17O5S6 and a molecular weight of 1925.42 g/mol. Its IUPAC name is (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol.

Molecular Properties

Compound Name(4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol
PubChem CID161386663
Molecular FormulaC97H72Cl5N17O5S6
Molecular Weight1925.42 g/mol
Exact Mass1921.27
IUPAC Name(4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol
SMILESCCc1cc(-c2cc(C(O)c3ccc(Cl)cc3)c(-c3ncc[nH]3)s2)ccn1.OC(c1ccc(Cl)cc1)c1cc(-c2ccnc3sccc23)sc1-c1ncc[nH]1.OC(c1ccc(Cl)cc1)c1cc(-c2ccncc2)sc1-c1ncc[nH]1.O[C@@H](c1ccc(Cl)cc1)c1cc(-c2ccnnc2)sc1-c1ncc[nH]1.O[C@H](c1ccc(Cl)cc1)c1cc(-c2ccnnc2)sc1-c1ncc[nH]1
InChIInChI=1S/C21H14ClN3OS2.C21H18ClN3OS.C19H14ClN3OS.2C18H13ClN4OS/c22-13-3-1-12(2-4-13)18(26)16-11-17(28-19(16)20-23-8-9-24-20)14-5-7-25-21-15(14)6-10-27-21;1-2-16-11-14(7-8-23-16)18-12-17(20(27-18)21-24-9-10-25-21)19(26)13-3-5-15(22)6-4-13;20-14-3-1-13(2-4-14)17(24)15-11-16(12-5-7-21-8-6-12)25-18(15)19-22-9-10-23-19;2*19-13-3-1-11(2-4-13)16(24)14-9-15(12-5-6-22-23-10-12)25-17(14)18-20-7-8-21-18/h1-11,18,26H,(H,23,24);3-12,19,26H,2H2,1H3,(H,24,25);1-11,17,24H,(H,22,23);2*1-10,16,24H,(H,20,21)/t;;;2*16-/m...10/s1
InChIKeyVSLBLYLGKZXKKK-JGBMOPGWSA-N
XLogP25.24
TPSA334.78 Ų
H-Bond Donors10
H-Bond Acceptors23
Rotatable Bonds21
Heavy Atoms130
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001925.42
LogP ≤ 525.24
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1023

Analyze (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol with MolForge

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Related Compounds

1-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-5-yl]-1-quinoxalin-6-ylethanol;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[1-(1H-indol-3-yl)ethyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-pyrazol-1-ylphenyl)methyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[1-(4-pyrimidin-2-ylphenyl)ethyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(quinoxalin-6-ylmethyl)-1,3-thiazole;1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-5-yl]-1-quinoxalin-6-ylethanol;[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-5-yl]-quinoxalin-6-ylmethanol;2-[(3E)-4-methylidene-3-prop-2-enylidenepiperidin-1-yl]-5-(1-pyridin-3-ylethyl)-1,3-thiazole
CID 158179250
(1S)-1-(4-chloro-2-fluorophenyl)-1-[2-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethanamine;(1R)-1-(4-chloro-2-fluorophenyl)-1-[2-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethanamine;(1S)-1-(4-chlorophenyl)-1-[2-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethanol;(1R)-1-(4-fluorophenyl)-1-[2-[4-[6-(2-methyl-1,3-thiazol-5-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethanol
CID 158384048
[5-(2-amino-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]-(4-chlorophenyl)methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-(2-isocyano-4-pyridinyl)thiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;N-[4-[4-[(4-chlorophenyl)methyl]-3-isocyano-5-methylthiophen-2-yl]-2-pyridinyl]acetamide
CID 158704291
(4-chlorophenyl)-[5-(2-chloro-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-(2-methyl-4-pyridinyl)thiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[3,2-b]pyridin-7-ylthiophen-3-yl]methanol;4-[4-[(4-chlorophenyl)methyl]-5-(1H-imidazol-2-yl)-3-isocyanothiophen-2-yl]pyridin-2-amine
CID 158735637
N-[4-[4-[azido-(4-chlorophenyl)methyl]-5-(1H-imidazol-2-yl)thiophen-2-yl]-2-pyridinyl]acetamide;N-[4-[4-[(4-chlorophenyl)-[(3R)-3-ethylpyrrolidin-1-yl]methyl]-5-(1H-1,2,4-triazol-5-yl)thiophen-2-yl]-2-pyridinyl]acetamide;N-[4-[4-[(4-chlorophenyl)-[(3R)-3-methylpyrrolidin-1-yl]methyl]-5-(1H-1,2,4-triazol-5-yl)thiophen-2-yl]-2-pyridinyl]acetamide;[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]-naphthalen-2-ylmethanol;4-[5-methyl-4-(naphthalen-2-ylmethyl)thiophen-2-yl]pyridine
CID 158871399
1-[4-[4-[(R)-(4-chlorophenyl)-(dimethylamino)methyl]-5-(1H-imidazol-2-yl)thiophen-2-yl]-2-pyridinyl]propan-2-one;1-[4-[4-[(4-chlorophenyl)-pyrazol-1-ylmethyl]-5-(1H-imidazol-2-yl)thiophen-2-yl]-2-pyridinyl]propan-2-one;(2-fluoronaphthalen-1-yl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(2-methyl-5-pyridin-4-ylthiophen-3-yl)-naphthalen-2-ylmethanol;[2-(4H-pyrazol-3-yl)-5-pyridin-4-ylthiophen-3-yl]-(4-pyridin-4-ylphenyl)methanol
CID 159110371
N-[(4-chlorophenyl)methyl]-3-(1,3-dimethylindazol-5-yl)-2,6-dimethylimidazo[1,2-b]pyridazin-8-amine;[4-[[[3-(1,3-dimethylindazol-5-yl)-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl]amino]methyl]phenyl]methanol;[5-[[[3-(1,3-dimethylindazol-5-yl)-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl]amino]methyl]-2-pyridinyl]methanol;3-(1,3-dimethylindazol-5-yl)-2,5-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine;3-(1,3-dimethylindazol-5-yl)-2,6-dimethyl-N-(thiophen-2-ylmethyl)imidazo[1,2-b]pyridazin-8-amine
CID 159342532
(4-chlorophenyl)-[5-[2-(hydroxymethyl)-4-pyridinyl]-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-(2-isocyano-4-pyridinyl)thiophen-3-yl]methanol;1-(4-chlorophenyl)-1-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]-N,N-dimethylmethanamine;4-[4-[(4-chlorophenyl)-methoxymethyl]-5-(1H-imidazol-2-yl)thiophen-2-yl]pyridine;4-[4-[(4-chlorophenyl)methyl]-5-(1H-imidazol-2-yl)thiophen-2-yl]pyridine
CID 160148259
(S)-(4-chlorophenyl)-[5-(2-chloro-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;N-[4-[4-[(4-chlorophenyl)-hydroxymethyl]-5-(1H-imidazol-2-yl)thiophen-2-yl]-2-pyridinyl]acetamide;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-(2-methyl-4-pyridinyl)thiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-quinolin-4-ylthiophen-3-yl]methanol;4-[4-[(4-chlorophenyl)methyl]-3-isocyano-5-methylthiophen-2-yl]pyridine
CID 160170937
1-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-5-yl]-1-quinoxalin-6-ylethanol;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[1-(1H-indol-3-yl)ethyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-pyrazol-1-ylphenyl)methyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(1-pyridin-3-ylethyl)-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[1-(4-pyrimidin-2-ylphenyl)ethyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(quinoxalin-6-ylmethyl)-1,3-thiazole;1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-5-yl]-1-quinoxalin-6-ylethanol;[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-5-yl]-quinoxalin-6-ylmethanol
CID 160784658
4-(2-chloro-5-ethenylphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;N-(4-chlorophenyl)-5-(1H-imidazol-2-yl)-N-methyl-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-amine;4-(2-fluoro-5-methylphenyl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-[2-methyl-6-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridin-3-yl]-4-phenyl-1,3-thiazole;1-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylimidazo[1,2-a]pyridin-6-yl]ethane-1,2-diol
CID 160845151
4-[4-[azetidin-1-yl-(4-chlorophenyl)methyl]-5-(1H-imidazol-2-yl)thiophen-2-yl]pyridine;(R)-(4-chlorophenyl)-[5-(2-fluoro-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;3-[4-[4-[(4-chlorophenyl)-hydroxymethyl]-5-(1H-imidazol-2-yl)thiophen-2-yl]-2-pyridinyl]propan-1-ol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-(2-isocyano-4-pyridinyl)thiophen-3-yl]methanol;(1R)-1-(4-chlorophenyl)-1-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]-N,N-dimethylmethanamine
CID 161725774

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol?
The IUPAC name of (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol (CID 161386663) is (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol.
What is the SMILES notation for (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol?
The canonical SMILES for (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol is CCc1cc(-c2cc(C(O)c3ccc(Cl)cc3)c(-c3ncc[nH]3)s2)ccn1.OC(c1ccc(Cl)cc1)c1cc(-c2ccnc3sccc23)sc1-c1ncc[nH]1.OC(c1ccc(Cl)cc1)c1cc(-c2ccncc2)sc1-c1ncc[nH]1.O[C@@H](c1ccc(Cl)cc1)c1cc(-c2ccnnc2)sc1-c1ncc[nH]1.O[C@H](c1ccc(Cl)cc1)c1cc(-c2ccnnc2)sc1-c1ncc[nH]1.
What is the InChIKey of (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol?
The InChIKey is VSLBLYLGKZXKKK-JGBMOPGWSA-N. The full InChI is InChI=1S/C21H14ClN3OS2.C21H18ClN3OS.C19H14ClN3OS.2C18H13ClN4OS/c22-13-3-1-12(2-4-13)18(26)16-11-17(28-19(16)20-23-8-9-24-20)14-5-7-25-21-15(14)6-10-27-21;1-2-16-11-14(7-8-23-16)18-12-17(20(27-18)21-24-9-10-25-21)19(26)13-3-5-15(22)6-4-13;20-14-3-1-13(2-4-14)17(24)15-11-16(12-5-7-21-8-6-12)25-18(15)19-22-9-10-23-19;2*19-13-3-1-11(2-4-13)16(24)14-9-15(12-5-6-22-23-10-12)25-17(14)18-20-7-8-21-18/h1-11,18,26H,(H,23,24);3-12,19,26H,2H2,1H3,(H,24,25);1-11,17,24H,(H,22,23);2*1-10,16,24H,(H,20,21)/t;;;2*16-/m...10/s1.
What are the key properties of (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol?
(4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol has a molecular weight of 1925.42 g/mol, XLogP of 25.24, 21 rotatable bonds, 10 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-[5-(2-ethyl-4-pyridinyl)-2-(1H-imidazol-2-yl)thiophen-3-yl]methanol;(R)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(S)-(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridazin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-pyridin-4-ylthiophen-3-yl]methanol;(4-chlorophenyl)-[2-(1H-imidazol-2-yl)-5-thieno[2,3-b]pyridin-4-ylthiophen-3-yl]methanol is sourced from PubChem (CID 161386663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).