6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one

C137H155Cl4F4N23O8 — CID 162138546

IUPAC6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one
SMILESCC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCCc6cn[nH]n6)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCCc6ncc[nH]6)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCN6CCOC6=O)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCn6ccoc6=O)N5)cc4)c(=O)nc3[nH]2)c1
InChIInChI=1S/C35H40ClFN6O.C34H39ClFN7O.C34H39ClFN5O3.C34H37ClFN5O3/c1-22(2)6-3-7-23-18-28(33(37)29(36)19-23)31-20-25-21-43(35(44)42-34(25)41-31)27-14-12-24(13-15-27)30-10-4-8-26(40-30)9-5-11-32-38-16-17-39-32;1-21(2)6-3-7-22-16-28(32(36)29(35)17-22)31-18-24-20-43(34(44)40-33(24)39-31)27-14-12-23(13-15-27)30-11-5-9-25(38-30)8-4-10-26-19-37-42-41-26;2*1-21(2)5-3-6-22-17-27(31(36)28(35)18-22)30-19-24-20-41(33(42)39-32(24)38-30)26-11-9-23(10-12-26)29-8-4-7-25(37-29)13-14-40-15-16-44-34(40)43/h12-22,26,30,40H,3-11H2,1-2H3,(H,38,39)(H,41,42,44);12-21,25,30,38H,3-11H2,1-2H3,(H,37,41,42)(H,39,40,44);9-12,17-21,25,29,37H,3-8,13-16H2,1-2H3,(H,38,39,42);9-12,15-21,25,29,37H,3-8,13-14H2,1-2H3,(H,38,39,42)/t26-,30-;25-,30+;2*25-,29-/m0100/s1
InChIKeyZJPUAQYLMFGXSU-UPLDUWFRSA-N
MW2469.70 g/mol
LogP29.92
Rot. Bonds42

About 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one

6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one (PubChem CID 162138546) has the molecular formula C137H155Cl4F4N23O8 and a molecular weight of 2469.70 g/mol. Its IUPAC name is 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one.

Molecular Properties

Compound Name6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one
PubChem CID162138546
Molecular FormulaC137H155Cl4F4N23O8
Molecular Weight2469.70 g/mol
Exact Mass2466.11
IUPAC Name6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one
SMILESCC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCCc6cn[nH]n6)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCCc6ncc[nH]6)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCN6CCOC6=O)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCn6ccoc6=O)N5)cc4)c(=O)nc3[nH]2)c1
InChIInChI=1S/C35H40ClFN6O.C34H39ClFN7O.C34H39ClFN5O3.C34H37ClFN5O3/c1-22(2)6-3-7-23-18-28(33(37)29(36)19-23)31-20-25-21-43(35(44)42-34(25)41-31)27-14-12-24(13-15-27)30-10-4-8-26(40-30)9-5-11-32-38-16-17-39-32;1-21(2)6-3-7-22-16-28(32(36)29(35)17-22)31-18-24-20-43(34(44)40-33(24)39-31)27-14-12-23(13-15-27)30-11-5-9-25(38-30)8-4-10-26-19-37-42-41-26;2*1-21(2)5-3-6-22-17-27(31(36)28(35)18-22)30-19-24-20-41(33(42)39-32(24)38-30)26-11-9-23(10-12-26)29-8-4-7-25(37-29)13-14-40-15-16-44-34(40)43/h12-22,26,30,40H,3-11H2,1-2H3,(H,38,39)(H,41,42,44);12-21,25,30,38H,3-11H2,1-2H3,(H,37,41,42)(H,39,40,44);9-12,17-21,25,29,37H,3-8,13-16H2,1-2H3,(H,38,39,42);9-12,15-21,25,29,37H,3-8,13-14H2,1-2H3,(H,38,39,42)/t26-,30-;25-,30+;2*25-,29-/m0100/s1
InChIKeyZJPUAQYLMFGXSU-UPLDUWFRSA-N
XLogP29.92
TPSA385.77 Ų
H-Bond Donors10
H-Bond Acceptors24
Rotatable Bonds42
Heavy Atoms176
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002469.70
LogP ≤ 529.92
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1024

Analyze 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one?
The IUPAC name of 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one (CID 162138546) is 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one.
What is the SMILES notation for 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one?
The canonical SMILES for 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one is CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCCc6cn[nH]n6)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCCc6ncc[nH]6)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCN6CCOC6=O)N5)cc4)c(=O)nc3[nH]2)c1.CC(C)CCCc1cc(Cl)c(F)c(-c2cc3cn(-c4ccc([C@@H]5CCC[C@@H](CCn6ccoc6=O)N5)cc4)c(=O)nc3[nH]2)c1.
What is the InChIKey of 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one?
The InChIKey is ZJPUAQYLMFGXSU-UPLDUWFRSA-N. The full InChI is InChI=1S/C35H40ClFN6O.C34H39ClFN7O.C34H39ClFN5O3.C34H37ClFN5O3/c1-22(2)6-3-7-23-18-28(33(37)29(36)19-23)31-20-25-21-43(35(44)42-34(25)41-31)27-14-12-24(13-15-27)30-10-4-8-26(40-30)9-5-11-32-38-16-17-39-32;1-21(2)6-3-7-22-16-28(32(36)29(35)17-22)31-18-24-20-43(34(44)40-33(24)39-31)27-14-12-23(13-15-27)30-11-5-9-25(38-30)8-4-10-26-19-37-42-41-26;2*1-21(2)5-3-6-22-17-27(31(36)28(35)18-22)30-19-24-20-41(33(42)39-32(24)38-30)26-11-9-23(10-12-26)29-8-4-7-25(37-29)13-14-40-15-16-44-34(40)43/h12-22,26,30,40H,3-11H2,1-2H3,(H,38,39)(H,41,42,44);12-21,25,30,38H,3-11H2,1-2H3,(H,37,41,42)(H,39,40,44);9-12,17-21,25,29,37H,3-8,13-16H2,1-2H3,(H,38,39,42);9-12,15-21,25,29,37H,3-8,13-14H2,1-2H3,(H,38,39,42)/t26-,30-;25-,30+;2*25-,29-/m0100/s1.
What are the key properties of 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one?
6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one has a molecular weight of 2469.70 g/mol, XLogP of 29.92, 42 rotatable bonds, 10 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(1H-imidazol-2-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazolidin-2-one;3-[2-[(2S,6S)-6-[4-[6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-2-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl]phenyl]piperidin-2-yl]ethyl]-1,3-oxazol-2-one;6-[3-chloro-2-fluoro-5-(4-methylpentyl)phenyl]-3-[4-[(2S,6S)-6-[3-(2H-triazol-4-yl)propyl]piperidin-2-yl]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-one is sourced from PubChem (CID 162138546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).