(2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide

C116H128F4N28O18S6 — CID 163881985

IUPAC(2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide
SMILESCC[C@H](C(=O)Nc1cccc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)[nH]nc12)N1CC2(C1)CS(=O)(=O)C2.CC[C@H](C(=O)Nc1ccnc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CC2(CC(OC)C2)C1.CC[C@H](C(=O)Nc1cncc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CC2(COC2)C1.CC[C@H](C(=O)Nc1nccc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CCC2(CC1)CS(=O)(=O)C2
InChIInChI=1S/C30H34FN7O5S2.C30H34FN7O4S.C28H30FN7O5S2.C28H30FN7O4S/c1-4-22(38-12-9-30(10-13-38)16-45(42,43)17-30)28(39)37-27-26-19(8-11-32-27)20(15-33-26)25-18(2)14-34-29(36-25)35-21-6-5-7-23(24(21)31)44(3,40)41;1-5-22(38-15-30(16-38)11-18(12-30)42-3)28(39)35-21-9-10-32-26-19(14-33-27(21)26)25-17(2)13-34-29(37-25)36-20-7-6-8-23(24(20)31)43(4,40)41;1-4-20(36-12-28(13-36)14-43(40,41)15-28)26(37)31-19-9-5-7-17-24(19)34-35-25(17)23-16(2)11-30-27(33-23)32-18-8-6-10-21(22(18)29)42(3,38)39;1-4-21(36-12-28(13-36)14-40-15-28)26(37)33-20-11-30-9-17-18(10-31-25(17)20)24-16(2)8-32-27(35-24)34-19-6-5-7-22(23(19)29)41(3,38)39/h5-8,11,14-15,22,33H,4,9-10,12-13,16-17H2,1-3H3,(H,32,37,39)(H,34,35,36);6-10,13-14,18,22,33H,5,11-12,15-16H2,1-4H3,(H,32,35,39)(H,34,36,37);5-11,20H,4,12-15H2,1-3H3,(H,31,37)(H,34,35)(H,30,32,33);5-11,21,31H,4,12-15H2,1-3H3,(H,33,37)(H,32,34,35)/t2*22-;20-;21-/m1111/s1
InChIKeyPUAOIMHVAGFACH-URDIBBEVSA-N
MW2470.87 g/mol
LogP15.01
Rot. Bonds33

About (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide

(2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide (PubChem CID 163881985) has the molecular formula C116H128F4N28O18S6 and a molecular weight of 2470.87 g/mol. Its IUPAC name is (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide.

Molecular Properties

Compound Name(2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide
PubChem CID163881985
Molecular FormulaC116H128F4N28O18S6
Molecular Weight2470.87 g/mol
Exact Mass2468.82
IUPAC Name(2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide
SMILESCC[C@H](C(=O)Nc1cccc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)[nH]nc12)N1CC2(C1)CS(=O)(=O)C2.CC[C@H](C(=O)Nc1ccnc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CC2(CC(OC)C2)C1.CC[C@H](C(=O)Nc1cncc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CC2(COC2)C1.CC[C@H](C(=O)Nc1nccc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CCC2(CC1)CS(=O)(=O)C2
InChIInChI=1S/C30H34FN7O5S2.C30H34FN7O4S.C28H30FN7O5S2.C28H30FN7O4S/c1-4-22(38-12-9-30(10-13-38)16-45(42,43)17-30)28(39)37-27-26-19(8-11-32-27)20(15-33-26)25-18(2)14-34-29(36-25)35-21-6-5-7-23(24(21)31)44(3,40)41;1-5-22(38-15-30(16-38)11-18(12-30)42-3)28(39)35-21-9-10-32-26-19(14-33-27(21)26)25-17(2)13-34-29(37-25)36-20-7-6-8-23(24(20)31)43(4,40)41;1-4-20(36-12-28(13-36)14-43(40,41)15-28)26(37)31-19-9-5-7-17-24(19)34-35-25(17)23-16(2)11-30-27(33-23)32-18-8-6-10-21(22(18)29)42(3,38)39;1-4-21(36-12-28(13-36)14-40-15-28)26(37)33-20-11-30-9-17-18(10-31-25(17)20)24-16(2)8-32-27(35-24)34-19-6-5-7-22(23(19)29)41(3,38)39/h5-8,11,14-15,22,33H,4,9-10,12-13,16-17H2,1-3H3,(H,32,37,39)(H,34,35,36);6-10,13-14,18,22,33H,5,11-12,15-16H2,1-4H3,(H,32,35,39)(H,34,36,37);5-11,20H,4,12-15H2,1-3H3,(H,31,37)(H,34,35)(H,30,32,33);5-11,21,31H,4,12-15H2,1-3H3,(H,33,37)(H,32,34,35)/t2*22-;20-;21-/m1111/s1
InChIKeyPUAOIMHVAGFACH-URDIBBEVSA-N
XLogP15.01
TPSA618.62 Ų
H-Bond Donors12
H-Bond Acceptors38
Rotatable Bonds33
Heavy Atoms172
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002470.87
LogP ≤ 515.01
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1038

Analyze (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide?
The IUPAC name of (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide (CID 163881985) is (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide.
What is the SMILES notation for (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide?
The canonical SMILES for (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide is CC[C@H](C(=O)Nc1cccc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)[nH]nc12)N1CC2(C1)CS(=O)(=O)C2.CC[C@H](C(=O)Nc1ccnc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CC2(CC(OC)C2)C1.CC[C@H](C(=O)Nc1cncc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CC2(COC2)C1.CC[C@H](C(=O)Nc1nccc2c(-c3nc(Nc4cccc(S(C)(=O)=O)c4F)ncc3C)c[nH]c12)N1CCC2(CC1)CS(=O)(=O)C2.
What is the InChIKey of (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide?
The InChIKey is PUAOIMHVAGFACH-URDIBBEVSA-N. The full InChI is InChI=1S/C30H34FN7O5S2.C30H34FN7O4S.C28H30FN7O5S2.C28H30FN7O4S/c1-4-22(38-12-9-30(10-13-38)16-45(42,43)17-30)28(39)37-27-26-19(8-11-32-27)20(15-33-26)25-18(2)14-34-29(36-25)35-21-6-5-7-23(24(21)31)44(3,40)41;1-5-22(38-15-30(16-38)11-18(12-30)42-3)28(39)35-21-9-10-32-26-19(14-33-27(21)26)25-17(2)13-34-29(37-25)36-20-7-6-8-23(24(20)31)43(4,40)41;1-4-20(36-12-28(13-36)14-43(40,41)15-28)26(37)31-19-9-5-7-17-24(19)34-35-25(17)23-16(2)11-30-27(33-23)32-18-8-6-10-21(22(18)29)42(3,38)39;1-4-21(36-12-28(13-36)14-40-15-28)26(37)33-20-11-30-9-17-18(10-31-25(17)20)24-16(2)8-32-27(35-24)34-19-6-5-7-22(23(19)29)41(3,38)39/h5-8,11,14-15,22,33H,4,9-10,12-13,16-17H2,1-3H3,(H,32,37,39)(H,34,35,36);6-10,13-14,18,22,33H,5,11-12,15-16H2,1-4H3,(H,32,35,39)(H,34,36,37);5-11,20H,4,12-15H2,1-3H3,(H,31,37)(H,34,35)(H,30,32,33);5-11,21,31H,4,12-15H2,1-3H3,(H,33,37)(H,32,34,35)/t2*22-;20-;21-/m1111/s1.
What are the key properties of (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide?
(2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide has a molecular weight of 2470.87 g/mol, XLogP of 15.01, 33 rotatable bonds, 12 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-2H-indazol-7-yl]butanamide;(2R)-2-(2,2-dioxo-2λ6-thia-7-azaspiro[3.5]nonan-7-yl)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-b]pyridin-7-yl]-2-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)butanamide;(2R)-N-[3-[2-(2-fluoro-3-methylsulfonylanilino)-5-methylpyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-7-yl]-2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)butanamide is sourced from PubChem (CID 163881985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).