N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide

C139H142F5N23O13 — CID 161192020

IUPACN-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
SMILESCCOC(=O)C1CCN(Cc2ccccc2)CC1NC(=O)c1ccc2[nH]nc(-c3ccncc3)c2c1.CNC(=O)[C@@H]1CC[C@@H](CC(=O)c2ccc3[nH]nc(-c4ccncc4)c3c2)CN1Cc1c(F)cccc1OC.COCCOc1cccc(F)c1CN1CCC[C@@H](CC(=O)c2ccc3c(c2)C(c2ccncc2)=NC3)C1.O=C(NC1COCCN(CCc2c(F)cccc2F)C1)c1ccc2[nH]nc(-c3ccncc3)c2c1.O=C(NC1COCCN(CCc2ccccc2F)C1)c1ccc2[nH]nc(-c3ccncc3)c2c1
InChIInChI=1S/C30H32FN3O3.C29H30FN5O3.C28H29N5O3.C26H25F2N5O2.C26H26FN5O2/c1-36-14-15-37-29-6-2-5-27(31)26(29)20-34-13-3-4-21(19-34)16-28(35)23-7-8-24-18-33-30(25(24)17-23)22-9-11-32-12-10-22;1-31-29(37)25-9-6-18(16-35(25)17-22-23(30)4-3-5-27(22)38-2)14-26(36)20-7-8-24-21(15-20)28(34-33-24)19-10-12-32-13-11-19;1-2-36-28(35)22-12-15-33(17-19-6-4-3-5-7-19)18-25(22)30-27(34)21-8-9-24-23(16-21)26(32-31-24)20-10-13-29-14-11-20;27-22-2-1-3-23(28)20(22)8-11-33-12-13-35-16-19(15-33)30-26(34)18-4-5-24-21(14-18)25(32-31-24)17-6-9-29-10-7-17;27-23-4-2-1-3-18(23)9-12-32-13-14-34-17-21(16-32)29-26(33)20-5-6-24-22(15-20)25(31-30-24)19-7-10-28-11-8-19/h2,5-12,17,21H,3-4,13-16,18-20H2,1H3;3-5,7-8,10-13,15,18,25H,6,9,14,16-17H2,1-2H3,(H,31,37)(H,33,34);3-11,13-14,16,22,25H,2,12,15,17-18H2,1H3,(H,30,34)(H,31,32);1-7,9-10,14,19H,8,11-13,15-16H2,(H,30,34)(H,31,32);1-8,10-11,15,21H,9,12-14,16-17H2,(H,29,33)(H,30,31)/t21-;18-,25-;;;/m00.../s1
InChIKeyUTVPOMCWDDZXLZ-KUIGDQDQSA-N
MW2437.80 g/mol
LogP20.28
Rot. Bonds37

About N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide

N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide (PubChem CID 161192020) has the molecular formula C139H142F5N23O13 and a molecular weight of 2437.80 g/mol. Its IUPAC name is N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
PubChem CID161192020
Molecular FormulaC139H142F5N23O13
Molecular Weight2437.80 g/mol
Exact Mass2436.11
IUPAC NameN-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
SMILESCCOC(=O)C1CCN(Cc2ccccc2)CC1NC(=O)c1ccc2[nH]nc(-c3ccncc3)c2c1.CNC(=O)[C@@H]1CC[C@@H](CC(=O)c2ccc3[nH]nc(-c4ccncc4)c3c2)CN1Cc1c(F)cccc1OC.COCCOc1cccc(F)c1CN1CCC[C@@H](CC(=O)c2ccc3c(c2)C(c2ccncc2)=NC3)C1.O=C(NC1COCCN(CCc2c(F)cccc2F)C1)c1ccc2[nH]nc(-c3ccncc3)c2c1.O=C(NC1COCCN(CCc2ccccc2F)C1)c1ccc2[nH]nc(-c3ccncc3)c2c1
InChIInChI=1S/C30H32FN3O3.C29H30FN5O3.C28H29N5O3.C26H25F2N5O2.C26H26FN5O2/c1-36-14-15-37-29-6-2-5-27(31)26(29)20-34-13-3-4-21(19-34)16-28(35)23-7-8-24-18-33-30(25(24)17-23)22-9-11-32-12-10-22;1-31-29(37)25-9-6-18(16-35(25)17-22-23(30)4-3-5-27(22)38-2)14-26(36)20-7-8-24-21(15-20)28(34-33-24)19-10-12-32-13-11-19;1-2-36-28(35)22-12-15-33(17-19-6-4-3-5-7-19)18-25(22)30-27(34)21-8-9-24-23(16-21)26(32-31-24)20-10-13-29-14-11-20;27-22-2-1-3-23(28)20(22)8-11-33-12-13-35-16-19(15-33)30-26(34)18-4-5-24-21(14-18)25(32-31-24)17-6-9-29-10-7-17;27-23-4-2-1-3-18(23)9-12-32-13-14-34-17-21(16-32)29-26(33)20-5-6-24-22(15-20)25(31-30-24)19-7-10-28-11-8-19/h2,5-12,17,21H,3-4,13-16,18-20H2,1H3;3-5,7-8,10-13,15,18,25H,6,9,14,16-17H2,1-2H3,(H,31,37)(H,33,34);3-11,13-14,16,22,25H,2,12,15,17-18H2,1H3,(H,30,34)(H,31,32);1-7,9-10,14,19H,8,11-13,15-16H2,(H,30,34)(H,31,32);1-8,10-11,15,21H,9,12-14,16-17H2,(H,29,33)(H,30,31)/t21-;18-,25-;;;/m00.../s1
InChIKeyUTVPOMCWDDZXLZ-KUIGDQDQSA-N
XLogP20.28
TPSA430.72 Ų
H-Bond Donors8
H-Bond Acceptors28
Rotatable Bonds37
Heavy Atoms180
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002437.80
LogP ≤ 520.28
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide with MolForge

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Related Compounds

(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide
CID 159765408
2-[6-cyclopropyl-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-(6-cyclopropyl-1-methylpiperidin-3-yl)-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[5,5-difluoro-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;1-[3-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-1H-indazol-5-yl]-2-[(3S)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]ethanone;N-[(3R)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
CID 158765164
N-[(3R,6S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-6-(methylcarbamoyl)piperidin-3-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
CID 70652372
2-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[(3S,5R)-5-(1,1-difluoroethyl)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[(3S,5S)-5-(1,1-difluoroethyl)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;N-[(3R)-1-(2-piperidin-1-ylprop-2-enyl)piperidin-3-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
CID 160508700
N-[1-[(2-fluoro-6-methylphenyl)methyl]azepan-3-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
CID 70652288
N-[4-[2-(3-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
CID 70652274
bis(2-[(3S,6S)-6-[4-[tert-butyl(dimethyl)silyl]oxy-1,2-oxazolidine-2-carbonyl]-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone);tert-butyl N-[2-[[(2S,5R)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[[3-(2-methyl-4-pyridinyl)-1H-indazole-5-carbonyl]amino]piperidine-2-carbonyl]amino]ethyl]carbamate;tert-butyl N-[3-[[(2S,5R)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[[3-(2-methyl-4-pyridinyl)-1H-indazole-5-carbonyl]amino]piperidine-2-carbonyl]amino]propyl]carbamate;N-[(3R,6S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-6-[4-[1-(1-methylcyclopropyl)oxyethenyl]piperazine-1-carbonyl]piperidin-3-yl]-3-(2-methyl-4-pyridinyl)-1H-indazole-5-carboxamide;N-[(3R,6S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-6-[(2-methylpropan-2-yl)oxycarbamoyl]piperidin-3-yl]-3-(2-methyl-4-pyridinyl)-1H-indazole-5-carboxamide
CID 161308630
1-[(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-indazol-5-yl]-2-oxoethyl]piperidin-2-yl]-4-phenylmethoxybutan-1-one
CID 149095975
3-(1-benzofuran-5-yl)-N-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1H-indazole-5-carboxamide
CID 70652885
2-[(3S,6S)-6-(3,3-difluoroazetidine-1-carbonyl)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone
CID 158981603
N-[(3R,6S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-6-[(4-fluorophenyl)carbamoyl]piperidin-3-yl]-3-(2-methyl-4-pyridinyl)-1H-indazole-5-carboxamide
CID 70652868
[2-amino-5-[6-[2-[(3S)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]acetyl]-3H-isoindol-1-yl]phenyl] acetate
CID 160976861

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide?
The IUPAC name of N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide (CID 161192020) is N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide.
What is the SMILES notation for N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide?
The canonical SMILES for N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide is CCOC(=O)C1CCN(Cc2ccccc2)CC1NC(=O)c1ccc2[nH]nc(-c3ccncc3)c2c1.CNC(=O)[C@@H]1CC[C@@H](CC(=O)c2ccc3[nH]nc(-c4ccncc4)c3c2)CN1Cc1c(F)cccc1OC.COCCOc1cccc(F)c1CN1CCC[C@@H](CC(=O)c2ccc3c(c2)C(c2ccncc2)=NC3)C1.O=C(NC1COCCN(CCc2c(F)cccc2F)C1)c1ccc2[nH]nc(-c3ccncc3)c2c1.O=C(NC1COCCN(CCc2ccccc2F)C1)c1ccc2[nH]nc(-c3ccncc3)c2c1.
What is the InChIKey of N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide?
The InChIKey is UTVPOMCWDDZXLZ-KUIGDQDQSA-N. The full InChI is InChI=1S/C30H32FN3O3.C29H30FN5O3.C28H29N5O3.C26H25F2N5O2.C26H26FN5O2/c1-36-14-15-37-29-6-2-5-27(31)26(29)20-34-13-3-4-21(19-34)16-28(35)23-7-8-24-18-33-30(25(24)17-23)22-9-11-32-12-10-22;1-31-29(37)25-9-6-18(16-35(25)17-22-23(30)4-3-5-27(22)38-2)14-26(36)20-7-8-24-21(15-20)28(34-33-24)19-10-12-32-13-11-19;1-2-36-28(35)22-12-15-33(17-19-6-4-3-5-7-19)18-25(22)30-27(34)21-8-9-24-23(16-21)26(32-31-24)20-10-13-29-14-11-20;27-22-2-1-3-23(28)20(22)8-11-33-12-13-35-16-19(15-33)30-26(34)18-4-5-24-21(14-18)25(32-31-24)17-6-9-29-10-7-17;27-23-4-2-1-3-18(23)9-12-32-13-14-34-17-21(16-32)29-26(33)20-5-6-24-22(15-20)25(31-30-24)19-7-10-28-11-8-19/h2,5-12,17,21H,3-4,13-16,18-20H2,1H3;3-5,7-8,10-13,15,18,25H,6,9,14,16-17H2,1-2H3,(H,31,37)(H,33,34);3-11,13-14,16,22,25H,2,12,15,17-18H2,1H3,(H,30,34)(H,31,32);1-7,9-10,14,19H,8,11-13,15-16H2,(H,30,34)(H,31,32);1-8,10-11,15,21H,9,12-14,16-17H2,(H,29,33)(H,30,31)/t21-;18-,25-;;;/m00.../s1.
What are the key properties of N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide?
N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide has a molecular weight of 2437.80 g/mol, XLogP of 20.28, 37 rotatable bonds, 8 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(2,6-difluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide;ethyl 1-benzyl-3-[(3-pyridin-4-yl-1H-indazole-5-carbonyl)amino]piperidine-4-carboxylate;2-[(3S)-1-[[2-fluoro-6-(2-methoxyethoxy)phenyl]methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;(2S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-N-methyl-5-[2-oxo-2-(3-pyridin-4-yl-1H-indazol-5-yl)ethyl]piperidine-2-carboxamide;N-[4-[2-(2-fluorophenyl)ethyl]-1,4-oxazepan-6-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide is sourced from PubChem (CID 161192020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).