(5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol

C84H105Cl5F2N18O12S2 — CID 159815183

IUPAC(5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol
SMILESCC(C)(C1CCN(C(=O)NCCN2CCOCC2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)NCc2ccncc2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CS(=O)(=O)N1CC(O)(c2cc(Cl)cc3cn[nH]c23)C1.CS(=O)(=O)N1CCC(O)(c2cc(Cl)cc3cn[nH]c23)CC1.OC(c1cc(Cl)cc2cn[nH]c12)C1CCC(F)(F)CC1
InChIInChI=1S/C23H34ClN5O3.C23H28ClN5O2.C14H15ClF2N2O.C13H16ClN3O3S.C11H12ClN3O3S/c1-23(2,21(30)19-14-18(24)13-16-15-26-27-20(16)19)17-3-6-29(7-4-17)22(31)25-5-8-28-9-11-32-12-10-28;1-23(2,21(30)19-12-18(24)11-16-14-27-28-20(16)19)17-5-9-29(10-6-17)22(31)26-13-15-3-7-25-8-4-15;15-10-5-9-7-18-19-12(9)11(6-10)13(20)8-1-3-14(16,17)4-2-8;1-21(19,20)17-4-2-13(18,3-5-17)11-7-10(14)6-9-8-15-16-12(9)11;1-19(17,18)15-5-11(16,6-15)9-3-8(12)2-7-4-13-14-10(7)9/h13-15,17,21,30H,3-12H2,1-2H3,(H,25,31)(H,26,27);3-4,7-8,11-12,14,17,21,30H,5-6,9-10,13H2,1-2H3,(H,26,31)(H,27,28);5-8,13,20H,1-4H2,(H,18,19);6-8,18H,2-5H2,1H3,(H,15,16);2-4,16H,5-6H2,1H3,(H,13,14)/t2*21-;;;/m11.../s1
InChIKeyNLNJYUMPVZOCQV-NOPJFSPJSA-N
MW1838.27 g/mol
LogP13.54
Rot. Bonds17

About (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol

(5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol (PubChem CID 159815183) has the molecular formula C84H105Cl5F2N18O12S2 and a molecular weight of 1838.27 g/mol. Its IUPAC name is (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol.

Molecular Properties

Compound Name(5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol
PubChem CID159815183
Molecular FormulaC84H105Cl5F2N18O12S2
Molecular Weight1838.27 g/mol
Exact Mass1834.60
IUPAC Name(5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol
SMILESCC(C)(C1CCN(C(=O)NCCN2CCOCC2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)NCc2ccncc2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CS(=O)(=O)N1CC(O)(c2cc(Cl)cc3cn[nH]c23)C1.CS(=O)(=O)N1CCC(O)(c2cc(Cl)cc3cn[nH]c23)CC1.OC(c1cc(Cl)cc2cn[nH]c12)C1CCC(F)(F)CC1
InChIInChI=1S/C23H34ClN5O3.C23H28ClN5O2.C14H15ClF2N2O.C13H16ClN3O3S.C11H12ClN3O3S/c1-23(2,21(30)19-14-18(24)13-16-15-26-27-20(16)19)17-3-6-29(7-4-17)22(31)25-5-8-28-9-11-32-12-10-28;1-23(2,21(30)19-12-18(24)11-16-14-27-28-20(16)19)17-5-9-29(10-6-17)22(31)26-13-15-3-7-25-8-4-15;15-10-5-9-7-18-19-12(9)11(6-10)13(20)8-1-3-14(16,17)4-2-8;1-21(19,20)17-4-2-13(18,3-5-17)11-7-10(14)6-9-8-15-16-12(9)11;1-19(17,18)15-5-11(16,6-15)9-3-8(12)2-7-4-13-14-10(7)9/h13-15,17,21,30H,3-12H2,1-2H3,(H,25,31)(H,26,27);3-4,7-8,11-12,14,17,21,30H,5-6,9-10,13H2,1-2H3,(H,26,31)(H,27,28);5-8,13,20H,1-4H2,(H,18,19);6-8,18H,2-5H2,1H3,(H,15,16);2-4,16H,5-6H2,1H3,(H,13,14)/t2*21-;;;/m11.../s1
InChIKeyNLNJYUMPVZOCQV-NOPJFSPJSA-N
XLogP13.54
TPSA409.35 Ų
H-Bond Donors12
H-Bond Acceptors19
Rotatable Bonds17
Heavy Atoms123
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001838.27
LogP ≤ 513.54
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1019

Analyze (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol with MolForge

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Related Compounds

1-(5-chloro-1H-indazol-7-yl)-2,2-difluoro-2-(1-methylsulfonylpiperidin-4-yl)ethanol;1-[2-(5-chloro-1H-indazol-7-yl)-2-hydroxy-7-azaspiro[3.5]nonan-7-yl]ethanone;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(4-methylphenyl)piperidine-1-carboxamide;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-[(1R,5S)-8-methylsulfonyl-8-azabicyclo[3.2.1]octan-3-yl]propan-1-ol
CID 157218928
4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2,2-difluoropropyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-methylpropyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-phenylpiperidine-1-carboxamide
CID 157860493
1-[4-[2-(5-chloro-1H-indazol-7-yl)-1,1-difluoro-2-hydroxyethyl]piperidin-1-yl]-2-(4-methylphenyl)ethanone;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-methylsulfonylpropyl)piperidine-1-carboxamide
CID 157945800
1-[4-[(2R)-2-(5-chloro-1H-indazol-7-yl)-1,1-difluoro-2-hydroxyethyl]piperidin-1-yl]-2-(3-fluoro-4-methylphenyl)ethanone;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3-cyanophenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(6-ethynyl-3-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-propylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-prop-2-ynylpiperidine-1-carboxamide
CID 158184368
1-[4-[2-(5-chloro-1H-indazol-7-yl)-1,1-difluoro-2-hydroxyethyl]piperidin-1-yl]-2-cyclohexylethanone;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(1R)-1-pyridin-2-ylethyl]piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(1S)-1-pyridin-2-ylethyl]piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide
CID 159334350
(5-chloro-4,6-difluoro-1H-indazol-7-yl)-(1-methylcyclohexyl)methanol;1-(5-chloro-1H-indazol-7-yl)-2-cyclobutyl-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-3,3-dicyclopropylcyclobutan-1-ol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(6-cyano-3-pyridinyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-ethoxypiperidine-1-carboxamide;(5-chloro-1H-indazol-7-yl)-(1-propylcyclobutyl)methanol;(5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclobutyl]methanol
CID 159678870
tert-butyl 4-[2-(5-chloro-1H-indazol-7-yl)-1,1-difluoro-2-hydroxyethyl]piperidine-1-carboxylate;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopenta-1,3-dien-1-ylpiperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3,3-difluorobutyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[(methyl-methylidene-oxo-lambda6-sulfanyl)methyl]piperidine-1-carboxamide
CID 160180998
4-[(2R)-2-(5-chloro-1H-indazol-7-yl)-1,1-difluoro-2-hydroxyethyl]-N-methylpiperidine-1-carboxamide;1-[4-[(2R)-2-(5-chloro-1H-indazol-7-yl)-1,1-difluoro-2-hydroxyethyl]piperidin-1-yl]-2-(4-fluoro-3-methylphenyl)ethanone;1-[4-[(2R)-2-(5-chloro-1H-indazol-7-yl)-1,1-difluoro-2-hydroxyethyl]piperidin-1-yl]-2-(2-methyl-4-pyridinyl)ethanone;1-[4-[(2R)-2-(5-chloro-1H-indazol-7-yl)-1,1-difluoro-2-hydroxyethyl]piperidin-1-yl]propan-1-one;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N'-ethynylpiperidine-1-carboximidamide
CID 160439495
4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[3-(1,1-difluoroethyl)phenyl]piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[4-(dimethylamino)phenyl]piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-ethylpiperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-fluoro-4-methylphenyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-[2-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 160964186
1-[4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]propan-1-one;(1S)-1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-[1-[1-(6-morpholin-4-yl-3-pyridinyl)ethenyl]piperidin-4-yl]propan-1-ol;(1S)-1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-[1-(1-pyridin-3-ylethenyl)piperidin-4-yl]propan-1-ol;(1S)-1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-[1-[1-[6-(trifluoromethyl)-3-pyridinyl]ethenyl]piperidin-4-yl]propan-1-ol
CID 160976800
(1S)-1-(5-chloro-1H-indazol-7-yl)-2-[1-(ethyl-methylidene-oxo-lambda6-sulfanyl)piperidin-4-yl]-2-methylpropan-1-ol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(cyclopropylmethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(3,3-difluorobutyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(6-methyl-3-pyridinyl)piperidine-1-carboxamide;4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(6-methyl-3-pyridinyl)piperidine-1-carboxamide
CID 161726345
(1S)-1-(5-chloro-1H-indazol-7-yl)-2-[1-[1-(5-chloro-2-pyridinyl)ethenyl]piperidin-4-yl]-2-methylpropan-1-ol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclobutylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-cyclopropylpiperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-ethylpiperidine-1-carboxamide
CID 157335946

Frequently Asked Questions

What is the IUPAC name of (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol?
The IUPAC name of (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol (CID 159815183) is (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol.
What is the SMILES notation for (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol?
The canonical SMILES for (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol is CC(C)(C1CCN(C(=O)NCCN2CCOCC2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CC(C)(C1CCN(C(=O)NCc2ccncc2)CC1)[C@H](O)c1cc(Cl)cc2cn[nH]c12.CS(=O)(=O)N1CC(O)(c2cc(Cl)cc3cn[nH]c23)C1.CS(=O)(=O)N1CCC(O)(c2cc(Cl)cc3cn[nH]c23)CC1.OC(c1cc(Cl)cc2cn[nH]c12)C1CCC(F)(F)CC1.
What is the InChIKey of (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol?
The InChIKey is NLNJYUMPVZOCQV-NOPJFSPJSA-N. The full InChI is InChI=1S/C23H34ClN5O3.C23H28ClN5O2.C14H15ClF2N2O.C13H16ClN3O3S.C11H12ClN3O3S/c1-23(2,21(30)19-14-18(24)13-16-15-26-27-20(16)19)17-3-6-29(7-4-17)22(31)25-5-8-28-9-11-32-12-10-28;1-23(2,21(30)19-12-18(24)11-16-14-27-28-20(16)19)17-5-9-29(10-6-17)22(31)26-13-15-3-7-25-8-4-15;15-10-5-9-7-18-19-12(9)11(6-10)13(20)8-1-3-14(16,17)4-2-8;1-21(19,20)17-4-2-13(18,3-5-17)11-7-10(14)6-9-8-15-16-12(9)11;1-19(17,18)15-5-11(16,6-15)9-3-8(12)2-7-4-13-14-10(7)9/h13-15,17,21,30H,3-12H2,1-2H3,(H,25,31)(H,26,27);3-4,7-8,11-12,14,17,21,30H,5-6,9-10,13H2,1-2H3,(H,26,31)(H,27,28);5-8,13,20H,1-4H2,(H,18,19);6-8,18H,2-5H2,1H3,(H,15,16);2-4,16H,5-6H2,1H3,(H,13,14)/t2*21-;;;/m11.../s1.
What are the key properties of (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol?
(5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol has a molecular weight of 1838.27 g/mol, XLogP of 13.54, 17 rotatable bonds, 12 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1H-indazol-7-yl)-(4,4-difluorocyclohexyl)methanol;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-1-carboxamide;4-[(1S)-1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]-N-(pyridin-4-ylmethyl)piperidine-1-carboxamide;3-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylazetidin-3-ol;4-(5-chloro-1H-indazol-7-yl)-1-methylsulfonylpiperidin-4-ol is sourced from PubChem (CID 159815183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).