2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone

C152H171ClF14N24O15S7 — CID 162074197

About 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone

2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone (PubChem CID 162074197) has the molecular formula C152H171ClF14N24O15S7 and a molecular weight of 3100.09 g/mol. Its IUPAC name is 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone.

Molecular Properties

• Compound Name: 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone
• PubChem CID: 162074197
• Molecular Formula: C152H171ClF14N24O15S7
• Molecular Weight: 3100.09 g/mol
• Exact Mass: 3097.09
• IUPAC Name: 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone
• SMILES: C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3ccc(C)cn3)cc(F)c2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3ccc(Cl)cn3)cc(F)c2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3ccc(F)cn3)cc(F)c2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3cnc(C)cn3)cc(F)c2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3cnc(C)cn3)ccc2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3cnc(OCC4CC4)cn3)ccc2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3ncc(C)cc3F)cc(F)c2F)N=C(N)C1(C)C
• InChI: InChI=1S/C24H29FN4O3S.C22H24F3N3O2S.C22H25F2N3O2S.C21H22ClF2N3O2S.C21H22F3N3O2S.C21H24F2N4O2S.C21H25FN4O2S/c1-23(2)22(26)29-24(3,14-33(23,4)31)17-9-16(7-8-18(17)25)10-20(30)19-11-28-21(12-27-19)32-13-15-5-6-15;1-12-6-16(24)19(27-10-12)17(29)9-13-7-14(18(25)15(23)8-13)22(4)11-31(5,30)21(2,3)20(26)28-22;1-13-6-7-17(26-11-13)18(28)10-14-8-15(19(24)16(23)9-14)22(4)12-30(5,29)21(2,3)20(25)27-22;2*1-20(2)19(25)27-21(3,11-30(20,4)29)14-7-12(8-15(23)18(14)24)9-17(28)16-6-5-13(22)10-26-16;1-12-9-26-16(10-25-12)17(28)8-13-6-14(18(23)15(22)7-13)21(4)11-30(5,29)20(2,3)19(24)27-21;1-13-10-25-17(11-24-13)18(27)9-14-6-7-16(22)15(8-14)21(4)12-29(5,28)20(2,3)19(23)26-21/h7-9,11-12,15H,4-6,10,13-14H2,1-3H3,(H2,26,29);6-8,10H,5,9,11H2,1-4H3,(H2,26,28);6-9,11H,5,10,12H2,1-4H3,(H2,25,27);2*5-8,10H,4,9,11H2,1-3H3,(H2,25,27);6-7,9-10H,5,8,11H2,1-4H3,(H2,24,27);6-8,10-11H,5,9,12H2,1-4H3,(H2,23,26)/t24-,33?;22-,31?;22-,30?;3*21-,30?;21-,29?/m0000000/s1
• InChIKey: ZBMKAQSPDMMXCF-WNPHODANSA-N
• XLogP: 20.92
• TPSA: 645.77 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 39
• Rotatable Bonds: 31
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3100.09
LogP ≤ 5	20.92
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone?

The IUPAC name of 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone (CID 162074197) is 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone.

What is the SMILES notation for 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone?

The canonical SMILES for 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone is C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3ccc(C)cn3)cc(F)c2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3ccc(Cl)cn3)cc(F)c2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3ccc(F)cn3)cc(F)c2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3cnc(C)cn3)cc(F)c2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3cnc(C)cn3)ccc2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3cnc(OCC4CC4)cn3)ccc2F)N=C(N)C1(C)C.C=S1(=O)C[C@@](C)(c2cc(CC(=O)c3ncc(C)cc3F)cc(F)c2F)N=C(N)C1(C)C.

What is the InChIKey of 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone?

The InChIKey is ZBMKAQSPDMMXCF-WNPHODANSA-N. The full InChI is InChI=1S/C24H29FN4O3S.C22H24F3N3O2S.C22H25F2N3O2S.C21H22ClF2N3O2S.C21H22F3N3O2S.C21H24F2N4O2S.C21H25FN4O2S/c1-23(2)22(26)29-24(3,14-33(23,4)31)17-9-16(7-8-18(17)25)10-20(30)19-11-28-21(12-27-19)32-13-15-5-6-15;1-12-6-16(24)19(27-10-12)17(29)9-13-7-14(18(25)15(23)8-13)22(4)11-31(5,30)21(2,3)20(26)28-22;1-13-6-7-17(26-11-13)18(28)10-14-8-15(19(24)16(23)9-14)22(4)12-30(5,29)21(2,3)20(25)27-22;2*1-20(2)19(25)27-21(3,11-30(20,4)29)14-7-12(8-15(23)18(14)24)9-17(28)16-6-5-13(22)10-26-16;1-12-9-26-16(10-25-12)17(28)8-13-6-14(18(23)15(22)7-13)21(4)11-30(5,29)20(2,3)19(24)27-21;1-13-10-25-17(11-24-13)18(27)9-14-6-7-16(22)15(8-14)21(4)12-29(5,28)20(2,3)19(23)26-21/h7-9,11-12,15H,4-6,10,13-14H2,1-3H3,(H2,26,29);6-8,10H,5,9,11H2,1-4H3,(H2,26,28);6-9,11H,5,10,12H2,1-4H3,(H2,25,27);2*5-8,10H,4,9,11H2,1-3H3,(H2,25,27);6-7,9-10H,5,8,11H2,1-4H3,(H2,24,27);6-8,10-11H,5,9,12H2,1-4H3,(H2,23,26)/t24-,33?;22-,31?;22-,30?;3*21-,30?;21-,29?/m0000000/s1.

What are the key properties of 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone?

2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone has a molecular weight of 3100.09 g/mol, XLogP of 20.92, 31 rotatable bonds, 7 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-chloro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(3-fluoro-5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-fluoro-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4,5-difluorophenyl]-1-(5-methyl-2-pyridinyl)ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-[5-(cyclopropylmethoxy)pyrazin-2-yl]ethanone;2-[3-[(3R)-5-amino-3,6,6-trimethyl-1-methylidene-1-oxo-2H-1,4-thiazin-3-yl]-4-fluorophenyl]-1-(5-methylpyrazin-2-yl)ethanone is sourced from PubChem (CID 162074197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).