5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide

C118H136ClF5N26O21 — CID 159128438

IUPAC5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
SMILESCC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3ccc[nH]c3=O)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cccc4[nH]cnc34)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cccc4ncnn34)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cnc4cccnn34)c(N3CCOCC3)cc2C1=O.Cn1ncc(C(=O)Nc2cc3c(cc2N2CCOCC2)C(=O)N(C[C@@H](F)C(C)(C)O)C3)c1Cl
InChIInChI=1S/C25H28FN5O4.2C24H27FN6O4.C23H27FN4O5.C22H27ClFN5O4/c1-25(2,34)21(26)13-31-12-15-10-19(20(11-17(15)24(31)33)30-6-8-35-9-7-30)29-23(32)16-4-3-5-18-22(16)28-14-27-18;1-24(2,34)20(25)14-30-13-15-10-17(18(11-16(15)23(30)33)29-6-8-35-9-7-29)28-22(32)19-12-26-21-4-3-5-27-31(19)21;1-24(2,34)20(25)13-30-12-15-10-17(19(11-16(15)23(30)33)29-6-8-35-9-7-29)28-22(32)18-4-3-5-21-26-14-27-31(18)21;1-23(2,32)19(24)13-28-12-14-10-17(26-21(30)15-4-3-5-25-20(15)29)18(11-16(14)22(28)31)27-6-8-33-9-7-27;1-22(2,32)18(24)12-29-11-13-8-16(26-20(30)15-10-25-27(3)19(15)23)17(9-14(13)21(29)31)28-4-6-33-7-5-28/h3-5,10-11,14,21,34H,6-9,12-13H2,1-2H3,(H,27,28)(H,29,32);3-5,10-12,20,34H,6-9,13-14H2,1-2H3,(H,28,32);3-5,10-11,14,20,34H,6-9,12-13H2,1-2H3,(H,28,32);3-5,10-11,19,32H,6-9,12-13H2,1-2H3,(H,25,29)(H,26,30);8-10,18,32H,4-7,11-12H2,1-3H3,(H,26,30)/t21-;2*20-;19-;18-/m11111/s1
InChIKeyKGOOGXYIEOENNL-HJLSERJESA-N
MW2384.99 g/mol
LogP10.24
Rot. Bonds30

About 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide

5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide (PubChem CID 159128438) has the molecular formula C118H136ClF5N26O21 and a molecular weight of 2384.99 g/mol. Its IUPAC name is 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
PubChem CID159128438
Molecular FormulaC118H136ClF5N26O21
Molecular Weight2384.99 g/mol
Exact Mass2383.00
IUPAC Name5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
SMILESCC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3ccc[nH]c3=O)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cccc4[nH]cnc34)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cccc4ncnn34)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cnc4cccnn34)c(N3CCOCC3)cc2C1=O.Cn1ncc(C(=O)Nc2cc3c(cc2N2CCOCC2)C(=O)N(C[C@@H](F)C(C)(C)O)C3)c1Cl
InChIInChI=1S/C25H28FN5O4.2C24H27FN6O4.C23H27FN4O5.C22H27ClFN5O4/c1-25(2,34)21(26)13-31-12-15-10-19(20(11-17(15)24(31)33)30-6-8-35-9-7-30)29-23(32)16-4-3-5-18-22(16)28-14-27-18;1-24(2,34)20(25)14-30-13-15-10-17(18(11-16(15)23(30)33)29-6-8-35-9-7-29)28-22(32)19-12-26-21-4-3-5-27-31(19)21;1-24(2,34)20(25)13-30-12-15-10-17(19(11-16(15)23(30)33)29-6-8-35-9-7-29)28-22(32)18-4-3-5-21-26-14-27-31(18)21;1-23(2,32)19(24)13-28-12-14-10-17(26-21(30)15-4-3-5-25-20(15)29)18(11-16(14)22(28)31)27-6-8-33-9-7-27;1-22(2,32)18(24)12-29-11-13-8-16(26-20(30)15-10-25-27(3)19(15)23)17(9-14(13)21(29)31)28-4-6-33-7-5-28/h3-5,10-11,14,21,34H,6-9,12-13H2,1-2H3,(H,27,28)(H,29,32);3-5,10-12,20,34H,6-9,13-14H2,1-2H3,(H,28,32);3-5,10-11,14,20,34H,6-9,12-13H2,1-2H3,(H,28,32);3-5,10-11,19,32H,6-9,12-13H2,1-2H3,(H,25,29)(H,26,30);8-10,18,32H,4-7,11-12H2,1-3H3,(H,26,30)/t21-;2*20-;19-;18-/m11111/s1
InChIKeyKGOOGXYIEOENNL-HJLSERJESA-N
XLogP10.24
TPSA550.29 Ų
H-Bond Donors12
H-Bond Acceptors35
Rotatable Bonds30
Heavy Atoms171
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002384.99
LogP ≤ 510.24
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

Analyze 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide
CID 146473732
5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide
CID 142501121
6-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129298089
N-[2-(2-fluoro-3-hydroxy-3-methylbutyl)-6-(2-oxa-8-azaspiro[4.5]decan-8-yl)-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146483114
N-[6-[4-[(1R)-2,2-difluoro-1-hydroxyethyl]piperidin-1-yl]-2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 135354459
N-[6-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-(2-fluoro-3-hydroxy-3-methylbutyl)-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146483214
N-[6-(4-cyano-4-methylpiperidin-1-yl)-2-(2-fluoro-3-hydroxy-3-methylbutyl)-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 135354504
6-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-[4-(oxetan-3-yl)piperazin-1-yl]-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146483032
N-[2-(2,2-difluoro-3-hydroxy-3-methylbutyl)-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129298092
N-[6-(4-cyclopentylpiperazin-1-yl)-2-(2-fluoro-3-hydroxy-3-methylbutyl)-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146482996
N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-1-oxo-6-[4-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]piperidin-1-yl]-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 135354455
N-[2-[(2S)-2-fluoro-3-hydroxybutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 135354425

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The IUPAC name of 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide (CID 159128438) is 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The canonical SMILES for 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide is CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3ccc[nH]c3=O)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cccc4[nH]cnc34)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cccc4ncnn34)c(N3CCOCC3)cc2C1=O.CC(C)(O)[C@H](F)CN1Cc2cc(NC(=O)c3cnc4cccnn34)c(N3CCOCC3)cc2C1=O.Cn1ncc(C(=O)Nc2cc3c(cc2N2CCOCC2)C(=O)N(C[C@@H](F)C(C)(C)O)C3)c1Cl.
What is the InChIKey of 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The InChIKey is KGOOGXYIEOENNL-HJLSERJESA-N. The full InChI is InChI=1S/C25H28FN5O4.2C24H27FN6O4.C23H27FN4O5.C22H27ClFN5O4/c1-25(2,34)21(26)13-31-12-15-10-19(20(11-17(15)24(31)33)30-6-8-35-9-7-30)29-23(32)16-4-3-5-18-22(16)28-14-27-18;1-24(2,34)20(25)14-30-13-15-10-17(18(11-16(15)23(30)33)29-6-8-35-9-7-29)28-22(32)19-12-26-21-4-3-5-27-31(19)21;1-24(2,34)20(25)13-30-12-15-10-17(19(11-16(15)23(30)33)29-6-8-35-9-7-29)28-22(32)18-4-3-5-21-26-14-27-31(18)21;1-23(2,32)19(24)13-28-12-14-10-17(26-21(30)15-4-3-5-25-20(15)29)18(11-16(14)22(28)31)27-6-8-33-9-7-27;1-22(2,32)18(24)12-29-11-13-8-16(26-20(30)15-10-25-27(3)19(15)23)17(9-14(13)21(29)31)28-4-6-33-7-5-28/h3-5,10-11,14,21,34H,6-9,12-13H2,1-2H3,(H,27,28)(H,29,32);3-5,10-12,20,34H,6-9,13-14H2,1-2H3,(H,28,32);3-5,10-11,14,20,34H,6-9,12-13H2,1-2H3,(H,28,32);3-5,10-11,19,32H,6-9,12-13H2,1-2H3,(H,25,29)(H,26,30);8-10,18,32H,4-7,11-12H2,1-3H3,(H,26,30)/t21-;2*20-;19-;18-/m11111/s1.
What are the key properties of 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide has a molecular weight of 2384.99 g/mol, XLogP of 10.24, 30 rotatable bonds, 12 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1-methylpyrazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-1H-benzimidazole-4-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-2-oxo-1H-pyridine-3-carboxamide;N-[2-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-morpholin-4-yl-1-oxo-3H-isoindol-5-yl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide is sourced from PubChem (CID 159128438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).