(6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane

C147H181BBr4F6IN19O23S4 — CID 157239782

IUPAC(6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)OC(=O)N1CCC(/N=C/C(=CN)B2OC(C)(C)C(C)(C)O2)CC1.COc1ccc(CCc2ccc(C(=O)c3cn(S(=O)(=O)c4ccccc4)c4ncc(Br)cc34)c(F)n2)cc1.COc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C=O)c(F)n2)cc1.COc1ncc(F)cc1C=O.COc1ncc(F)cc1CCc1ccc(C(=O)c2cn(S(=O)(=O)c3ccccc3)c3ncc(Br)cc23)c(F)n1.Nc1ccc(C(=O)c2cn(S(=O)(=O)c3ccccc3)c3ncc(Br)cc23)c(F)n1.O=S(=O)(c1ccccc1)n1cc(I)c2cc(Br)cnc21
InChIInChI=1S/C28H21BrFN3O4S.C27H19BrF2N4O4S.C19H34BN3O4.C19H12BrFN4O3S.C19H21FN2O4.C13H8BrIN2O2S.C7H6FNO2.15CH4/c1-37-21-12-8-18(9-13-21)7-10-20-11-14-23(27(30)32-20)26(34)25-17-33(28-24(25)15-19(29)16-31-28)38(35,36)22-5-3-2-4-6-22;1-38-27-16(11-18(29)14-32-27)7-8-19-9-10-21(25(30)33-19)24(35)23-15-34(26-22(23)12-17(28)13-31-26)39(36,37)20-5-3-2-4-6-20;1-17(2,3)25-16(24)23-10-8-15(9-11-23)22-13-14(12-21)20-26-18(4,5)19(6,7)27-20;20-11-8-14-15(17(26)13-6-7-16(22)24-18(13)21)10-25(19(14)23-9-11)29(27,28)12-4-2-1-3-5-12;1-19(2,3)26-18(24)22(11-13-5-8-15(25-4)9-6-13)16-10-7-14(12-23)17(20)21-16;14-9-6-11-12(15)8-17(13(11)16-7-9)20(18,19)10-4-2-1-3-5-10;1-11-7-5(4-10)2-6(8)3-9-7;;;;;;;;;;;;;;;/h2-6,8-9,11-17H,7,10H2,1H3;2-6,9-15H,7-8H2,1H3;12-13,15H,8-11,21H2,1-7H3;1-10H,(H2,22,24);5-10,12H,11H2,1-4H3;1-8H;2-4H,1H3;15*1H4/b;;14-12?,22-13+;;;;;;;;;;;;;;;;;;;
InChIKeyKBFBUHMRHBKNNK-PLHZUCHBSA-N
MW3281.76 g/mol
LogP35.24
Rot. Bonds32

About (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane

(6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane (PubChem CID 157239782) has the molecular formula C147H181BBr4F6IN19O23S4 and a molecular weight of 3281.76 g/mol. Its IUPAC name is (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane.

Molecular Properties

Compound Name(6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane
PubChem CID157239782
Molecular FormulaC147H181BBr4F6IN19O23S4
Molecular Weight3281.76 g/mol
Exact Mass3275.82
IUPAC Name(6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)OC(=O)N1CCC(/N=C/C(=CN)B2OC(C)(C)C(C)(C)O2)CC1.COc1ccc(CCc2ccc(C(=O)c3cn(S(=O)(=O)c4ccccc4)c4ncc(Br)cc34)c(F)n2)cc1.COc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C=O)c(F)n2)cc1.COc1ncc(F)cc1C=O.COc1ncc(F)cc1CCc1ccc(C(=O)c2cn(S(=O)(=O)c3ccccc3)c3ncc(Br)cc23)c(F)n1.Nc1ccc(C(=O)c2cn(S(=O)(=O)c3ccccc3)c3ncc(Br)cc23)c(F)n1.O=S(=O)(c1ccccc1)n1cc(I)c2cc(Br)cnc21
InChIInChI=1S/C28H21BrFN3O4S.C27H19BrF2N4O4S.C19H34BN3O4.C19H12BrFN4O3S.C19H21FN2O4.C13H8BrIN2O2S.C7H6FNO2.15CH4/c1-37-21-12-8-18(9-13-21)7-10-20-11-14-23(27(30)32-20)26(34)25-17-33(28-24(25)15-19(29)16-31-28)38(35,36)22-5-3-2-4-6-22;1-38-27-16(11-18(29)14-32-27)7-8-19-9-10-21(25(30)33-19)24(35)23-15-34(26-22(23)12-17(28)13-31-26)39(36,37)20-5-3-2-4-6-20;1-17(2,3)25-16(24)23-10-8-15(9-11-23)22-13-14(12-21)20-26-18(4,5)19(6,7)27-20;20-11-8-14-15(17(26)13-6-7-16(22)24-18(13)21)10-25(19(14)23-9-11)29(27,28)12-4-2-1-3-5-12;1-19(2,3)26-18(24)22(11-13-5-8-15(25-4)9-6-13)16-10-7-14(12-23)17(20)21-16;14-9-6-11-12(15)8-17(13(11)16-7-9)20(18,19)10-4-2-1-3-5-10;1-11-7-5(4-10)2-6(8)3-9-7;;;;;;;;;;;;;;;/h2-6,8-9,11-17H,7,10H2,1H3;2-6,9-15H,7-8H2,1H3;12-13,15H,8-11,21H2,1-7H3;1-10H,(H2,22,24);5-10,12H,11H2,1-4H3;1-8H;2-4H,1H3;15*1H4/b;;14-12?,22-13+;;;;;;;;;;;;;;;;;;;
InChIKeyKBFBUHMRHBKNNK-PLHZUCHBSA-N
XLogP35.24
TPSA549.39 Ų
H-Bond Donors2
H-Bond Acceptors40
Rotatable Bonds32
Heavy Atoms205
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003281.76
LogP ≤ 535.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(Benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate
CID 123148719
(6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[(4-methoxyphenyl)methylamino]-3-pyridinyl]methanone;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;tert-butyl formate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane
CID 160698942

Frequently Asked Questions

What is the IUPAC name of (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane?
The IUPAC name of (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane (CID 157239782) is (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane.
What is the SMILES notation for (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane?
The canonical SMILES for (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)OC(=O)N1CCC(/N=C/C(=CN)B2OC(C)(C)C(C)(C)O2)CC1.COc1ccc(CCc2ccc(C(=O)c3cn(S(=O)(=O)c4ccccc4)c4ncc(Br)cc34)c(F)n2)cc1.COc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C=O)c(F)n2)cc1.COc1ncc(F)cc1C=O.COc1ncc(F)cc1CCc1ccc(C(=O)c2cn(S(=O)(=O)c3ccccc3)c3ncc(Br)cc23)c(F)n1.Nc1ccc(C(=O)c2cn(S(=O)(=O)c3ccccc3)c3ncc(Br)cc23)c(F)n1.O=S(=O)(c1ccccc1)n1cc(I)c2cc(Br)cnc21.
What is the InChIKey of (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane?
The InChIKey is KBFBUHMRHBKNNK-PLHZUCHBSA-N. The full InChI is InChI=1S/C28H21BrFN3O4S.C27H19BrF2N4O4S.C19H34BN3O4.C19H12BrFN4O3S.C19H21FN2O4.C13H8BrIN2O2S.C7H6FNO2.15CH4/c1-37-21-12-8-18(9-13-21)7-10-20-11-14-23(27(30)32-20)26(34)25-17-33(28-24(25)15-19(29)16-31-28)38(35,36)22-5-3-2-4-6-22;1-38-27-16(11-18(29)14-32-27)7-8-19-9-10-21(25(30)33-19)24(35)23-15-34(26-22(23)12-17(28)13-31-26)39(36,37)20-5-3-2-4-6-20;1-17(2,3)25-16(24)23-10-8-15(9-11-23)22-13-14(12-21)20-26-18(4,5)19(6,7)27-20;20-11-8-14-15(17(26)13-6-7-16(22)24-18(13)21)10-25(19(14)23-9-11)29(27,28)12-4-2-1-3-5-12;1-19(2,3)26-18(24)22(11-13-5-8-15(25-4)9-6-13)16-10-7-14(12-23)17(20)21-16;14-9-6-11-12(15)8-17(13(11)16-7-9)20(18,19)10-4-2-1-3-5-10;1-11-7-5(4-10)2-6(8)3-9-7;;;;;;;;;;;;;;;/h2-6,8-9,11-17H,7,10H2,1H3;2-6,9-15H,7-8H2,1H3;12-13,15H,8-11,21H2,1-7H3;1-10H,(H2,22,24);5-10,12H,11H2,1-4H3;1-8H;2-4H,1H3;15*1H4/b;;14-12?,22-13+;;;;;;;;;;;;;;;;;;;.
What are the key properties of (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane?
(6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane has a molecular weight of 3281.76 g/mol, XLogP of 35.24, 32 rotatable bonds, 2 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for (6-amino-2-fluoro-3-pyridinyl)-[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]methanone;1-(benzenesulfonyl)-5-bromo-3-iodopyrrolo[2,3-b]pyridine;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(5-fluoro-2-methoxy-3-pyridinyl)ethyl]-3-pyridinyl]methanone;[1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridin-3-yl]-[2-fluoro-6-[2-(4-methoxyphenyl)ethyl]-3-pyridinyl]methanone;tert-butyl 4-[[3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enylidene]amino]piperidine-1-carboxylate;tert-butyl N-(6-fluoro-5-formyl-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]carbamate;5-fluoro-2-methoxypyridine-3-carbaldehyde;methane is sourced from PubChem (CID 157239782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).