2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone

C162H141F11N20O11S3 — CID 159967571

IUPAC2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone
SMILESCC1=C(c2ccc(CC(=O)c3ccccc3F)cc2)CN(c2nccs2)CC1.CC1=C(c2ccc(CC(=O)c3ccncc3F)cc2)CN(c2ccccn2)CC1.CC1=C(c2ccc(CC(=O)c3ccncc3F)cc2)CN(c2nc3ccccc3o2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nc(C)co2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2ncco2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nccs2)CC1.O=CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nccs2)CC1
InChIInChI=1S/C26H22FN3O2.C24H22FN3O.C23H21F2N3O2.C23H21FN2OS.C22H17F2N3O2S.C22H19F2N3O2.C22H19F2N3OS/c1-17-11-13-30(26-29-23-4-2-3-5-25(23)32-26)16-21(17)19-8-6-18(7-9-19)14-24(31)20-10-12-28-15-22(20)27;1-17-10-13-28(24-4-2-3-11-27-24)16-21(17)19-7-5-18(6-8-19)14-23(29)20-9-12-26-15-22(20)25;1-14-10-11-28(23-26-15(2)13-30-23)12-18(14)16-6-8-17(9-7-16)27-22(29)21-19(24)4-3-5-20(21)25;1-16-10-12-26(23-25-11-13-28-23)15-20(16)18-8-6-17(7-9-18)14-22(27)19-4-2-3-5-21(19)24;23-18-2-1-3-19(24)20(18)21(29)26-16-6-4-14(5-7-16)17-12-27(10-8-15(17)13-28)22-25-9-11-30-22;2*1-14-9-11-27(22-25-10-12-29-22)13-17(14)15-5-7-16(8-6-15)26-21(28)20-18(23)3-2-4-19(20)24/h2-10,12,15H,11,13-14,16H2,1H3;2-9,11-12,15H,10,13-14,16H2,1H3;3-9,13H,10-12H2,1-2H3,(H,27,29);2-9,11,13H,10,12,14-15H2,1H3;1-7,9,11,13H,8,10,12H2,(H,26,29);2*2-8,10,12H,9,11,13H2,1H3,(H,26,28)
InChIKeyOEDBCNGANXIGMV-UHFFFAOYSA-N
MW2849.22 g/mol
LogP35.57
Rot. Bonds32

About 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone

2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone (PubChem CID 159967571) has the molecular formula C162H141F11N20O11S3 and a molecular weight of 2849.22 g/mol. Its IUPAC name is 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone.

Molecular Properties

Compound Name2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone
PubChem CID159967571
Molecular FormulaC162H141F11N20O11S3
Molecular Weight2849.22 g/mol
Exact Mass2847.01
IUPAC Name2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone
SMILESCC1=C(c2ccc(CC(=O)c3ccccc3F)cc2)CN(c2nccs2)CC1.CC1=C(c2ccc(CC(=O)c3ccncc3F)cc2)CN(c2ccccn2)CC1.CC1=C(c2ccc(CC(=O)c3ccncc3F)cc2)CN(c2nc3ccccc3o2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nc(C)co2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2ncco2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nccs2)CC1.O=CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nccs2)CC1
InChIInChI=1S/C26H22FN3O2.C24H22FN3O.C23H21F2N3O2.C23H21FN2OS.C22H17F2N3O2S.C22H19F2N3O2.C22H19F2N3OS/c1-17-11-13-30(26-29-23-4-2-3-5-25(23)32-26)16-21(17)19-8-6-18(7-9-19)14-24(31)20-10-12-28-15-22(20)27;1-17-10-13-28(24-4-2-3-11-27-24)16-21(17)19-7-5-18(6-8-19)14-23(29)20-9-12-26-15-22(20)25;1-14-10-11-28(23-26-15(2)13-30-23)12-18(14)16-6-8-17(9-7-16)27-22(29)21-19(24)4-3-5-20(21)25;1-16-10-12-26(23-25-11-13-28-23)15-20(16)18-8-6-17(7-9-18)14-22(27)19-4-2-3-5-21(19)24;23-18-2-1-3-19(24)20(18)21(29)26-16-6-4-14(5-7-16)17-12-27(10-8-15(17)13-28)22-25-9-11-30-22;2*1-14-9-11-27(22-25-10-12-29-22)13-17(14)15-5-7-16(8-6-15)26-21(28)20-18(23)3-2-4-19(20)24/h2-10,12,15H,11,13-14,16H2,1H3;2-9,11-12,15H,10,13-14,16H2,1H3;3-9,13H,10-12H2,1-2H3,(H,27,29);2-9,11,13H,10,12,14-15H2,1H3;1-7,9,11,13H,8,10,12H2,(H,26,29);2*2-8,10,12H,9,11,13H2,1H3,(H,26,28)
InChIKeyOEDBCNGANXIGMV-UHFFFAOYSA-N
XLogP35.57
TPSA362.79 Ų
H-Bond Donors4
H-Bond Acceptors30
Rotatable Bonds32
Heavy Atoms207
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002849.22
LogP ≤ 535.57
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

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

Analyze 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone?
The IUPAC name of 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone (CID 159967571) is 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone.
What is the SMILES notation for 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone?
The canonical SMILES for 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone is CC1=C(c2ccc(CC(=O)c3ccccc3F)cc2)CN(c2nccs2)CC1.CC1=C(c2ccc(CC(=O)c3ccncc3F)cc2)CN(c2ccccn2)CC1.CC1=C(c2ccc(CC(=O)c3ccncc3F)cc2)CN(c2nc3ccccc3o2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nc(C)co2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2ncco2)CC1.CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nccs2)CC1.O=CC1=C(c2ccc(NC(=O)c3c(F)cccc3F)cc2)CN(c2nccs2)CC1.
What is the InChIKey of 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone?
The InChIKey is OEDBCNGANXIGMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22FN3O2.C24H22FN3O.C23H21F2N3O2.C23H21FN2OS.C22H17F2N3O2S.C22H19F2N3O2.C22H19F2N3OS/c1-17-11-13-30(26-29-23-4-2-3-5-25(23)32-26)16-21(17)19-8-6-18(7-9-19)14-24(31)20-10-12-28-15-22(20)27;1-17-10-13-28(24-4-2-3-11-27-24)16-21(17)19-7-5-18(6-8-19)14-23(29)20-9-12-26-15-22(20)25;1-14-10-11-28(23-26-15(2)13-30-23)12-18(14)16-6-8-17(9-7-16)27-22(29)21-19(24)4-3-5-20(21)25;1-16-10-12-26(23-25-11-13-28-23)15-20(16)18-8-6-17(7-9-18)14-22(27)19-4-2-3-5-21(19)24;23-18-2-1-3-19(24)20(18)21(29)26-16-6-4-14(5-7-16)17-12-27(10-8-15(17)13-28)22-25-9-11-30-22;2*1-14-9-11-27(22-25-10-12-29-22)13-17(14)15-5-7-16(8-6-15)26-21(28)20-18(23)3-2-4-19(20)24/h2-10,12,15H,11,13-14,16H2,1H3;2-9,11-12,15H,10,13-14,16H2,1H3;3-9,13H,10-12H2,1-2H3,(H,27,29);2-9,11,13H,10,12,14-15H2,1H3;1-7,9,11,13H,8,10,12H2,(H,26,29);2*2-8,10,12H,9,11,13H2,1H3,(H,26,28).
What are the key properties of 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone?
2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone has a molecular weight of 2849.22 g/mol, XLogP of 35.57, 32 rotatable bonds, 4 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-(1,3-benzoxazol-2-yl)-4-methyl-3,6-dihydro-2H-pyridin-5-yl]phenyl]-1-(3-fluoro-4-pyridinyl)ethanone;2,6-difluoro-N-[4-[4-formyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(4-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;2,6-difluoro-N-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide;1-(2-fluorophenyl)-2-[4-[4-methyl-1-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]ethanone;1-(3-fluoro-4-pyridinyl)-2-[4-(4-methyl-1-pyridin-2-yl-3,6-dihydro-2H-pyridin-5-yl)phenyl]ethanone is sourced from PubChem (CID 159967571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).