(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile

C148H130F2N26O8 — CID 158603084

About (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile

(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile (PubChem CID 158603084) has the molecular formula C148H130F2N26O8 and a molecular weight of 2438.84 g/mol. Its IUPAC name is (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile.

Molecular Properties

• Compound Name: (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile
• PubChem CID: 158603084
• Molecular Formula: C148H130F2N26O8
• Molecular Weight: 2438.84 g/mol
• Exact Mass: 2437.05
• IUPAC Name: (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile
• SMILES: C[C@H]1C(O)=C(C#N)C[C@@]2(C)c3c(c(-c4ccccn4)nn3-c3ccc(-c4cncc(F)c4)cc3)CC[C@H]12.Cc1cc(-c2ccc(-n3nc(-c4ccccc4F)c4c3[C@]3(C)CC(C#N)C(=O)[C@H](C)[C@H]3CC4)cc2)cnn1.Cc1ccc(-c2nn(-c3ccc(-c4ncon4)cc3)c3c2CC[C@@H]2[C@@H](C)C(=O)C(C#N)=C[C@@]32C)cc1.Cc1ccc(-c2nn(-c3ccc(-c4noc(C)n4)cc3)c3c2CC[C@@H]2[C@@H](C)C(=O)C(C#N)=C[C@@]32C)cc1.Cc1nc(-c2ccc(-n3nc(-c4cccnc4)c4c3[C@]3(C)C=C(C#N)C(=O)[C@H](C)[C@H]3CC4)cc2)no1
• InChI: InChI=1S/C31H28FN5O.C30H26FN5O.C30H27N5O2.C29H25N5O2.C28H24N6O2/c1-18-14-21(17-34-35-18)20-8-10-23(11-9-20)37-30-25(28(36-37)24-6-4-5-7-27(24)32)12-13-26-19(2)29(38)22(16-33)15-31(26,30)3;1-18-25-11-10-24-27(26-5-3-4-12-34-26)35-36(29(24)30(25,2)14-21(15-32)28(18)37)23-8-6-19(7-9-23)20-13-22(31)17-33-16-20;1-17-5-7-20(8-6-17)26-24-13-14-25-18(2)27(36)22(16-31)15-30(25,4)28(24)35(33-26)23-11-9-21(10-12-23)29-32-19(3)37-34-29;1-17-4-6-19(7-5-17)25-23-12-13-24-18(2)26(35)21(15-30)14-29(24,3)27(23)34(32-25)22-10-8-20(9-11-22)28-31-16-36-33-28;1-16-23-11-10-22-24(19-5-4-12-30-15-19)32-34(26(22)28(23,3)13-20(14-29)25(16)35)21-8-6-18(7-9-21)27-31-17(2)36-33-27/h4-11,14,17,19,22,26H,12-13,15H2,1-3H3;3-9,12-13,16-18,25,37H,10-11,14H2,1-2H3;5-12,15,18,25H,13-14H2,1-4H3;4-11,14,16,18,24H,12-13H2,1-3H3;4-9,12-13,15-16,23H,10-11H2,1-3H3/t19-,22?,26-,31-;2*18-,25-,30-;18-,24-,29-;16-,23-,28-/m11111/s1
• InChIKey: HVWNDZBMLTYQPI-KUOHJRKOSA-N
• XLogP: 28.21
• TPSA: 477.77 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 34
• Rotatable Bonds: 15
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2438.84
LogP ≤ 5	28.21
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'cyano_keto_A(2)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile?

The IUPAC name of (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile (CID 158603084) is (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile.

What is the SMILES notation for (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile?

The canonical SMILES for (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile is C[C@H]1C(O)=C(C#N)C[C@@]2(C)c3c(c(-c4ccccn4)nn3-c3ccc(-c4cncc(F)c4)cc3)CC[C@H]12.Cc1cc(-c2ccc(-n3nc(-c4ccccc4F)c4c3[C@]3(C)CC(C#N)C(=O)[C@H](C)[C@H]3CC4)cc2)cnn1.Cc1ccc(-c2nn(-c3ccc(-c4ncon4)cc3)c3c2CC[C@@H]2[C@@H](C)C(=O)C(C#N)=C[C@@]32C)cc1.Cc1ccc(-c2nn(-c3ccc(-c4noc(C)n4)cc3)c3c2CC[C@@H]2[C@@H](C)C(=O)C(C#N)=C[C@@]32C)cc1.Cc1nc(-c2ccc(-n3nc(-c4cccnc4)c4c3[C@]3(C)C=C(C#N)C(=O)[C@H](C)[C@H]3CC4)cc2)no1.

What is the InChIKey of (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile?

The InChIKey is HVWNDZBMLTYQPI-KUOHJRKOSA-N. The full InChI is InChI=1S/C31H28FN5O.C30H26FN5O.C30H27N5O2.C29H25N5O2.C28H24N6O2/c1-18-14-21(17-34-35-18)20-8-10-23(11-9-20)37-30-25(28(36-37)24-6-4-5-7-27(24)32)12-13-26-19(2)29(38)22(16-33)15-31(26,30)3;1-18-25-11-10-24-27(26-5-3-4-12-34-26)35-36(29(24)30(25,2)14-21(15-32)28(18)37)23-8-6-19(7-9-23)20-13-22(31)17-33-16-20;1-17-5-7-20(8-6-17)26-24-13-14-25-18(2)27(36)22(16-31)15-30(25,4)28(24)35(33-26)23-11-9-21(10-12-23)29-32-19(3)37-34-29;1-17-4-6-19(7-5-17)25-23-12-13-24-18(2)26(35)21(15-30)14-29(24,3)27(23)34(32-25)22-10-8-20(9-11-22)28-31-16-36-33-28;1-16-23-11-10-22-24(19-5-4-12-30-15-19)32-34(26(22)28(23,3)13-20(14-29)25(16)35)21-8-6-18(7-9-21)27-31-17(2)36-33-27/h4-11,14,17,19,22,26H,12-13,15H2,1-3H3;3-9,12-13,16-18,25,37H,10-11,14H2,1-2H3;5-12,15,18,25H,13-14H2,1-4H3;4-11,14,16,18,24H,12-13H2,1-3H3;4-9,12-13,15-16,23H,10-11H2,1-3H3/t19-,22?,26-,31-;2*18-,25-,30-;18-,24-,29-;16-,23-,28-/m11111/s1.

What are the key properties of (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile?

(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile has a molecular weight of 2438.84 g/mol, XLogP of 28.21, 15 rotatable bonds, 1 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for (5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(4-methylphenyl)-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-3-pyridin-3-yl-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aS)-6,9a-dimethyl-3-(4-methylphenyl)-1-[4-(1,2,4-oxadiazol-3-yl)phenyl]-7-oxo-4,5,5a,6-tetrahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-3-(2-fluorophenyl)-6,9a-dimethyl-1-[4-(6-methylpyridazin-4-yl)phenyl]-7-oxo-4,5,5a,6,8,9-hexahydrobenzo[g]indazole-8-carbonitrile;(5aR,6R,9aR)-1-[4-(5-fluoro-3-pyridinyl)phenyl]-7-hydroxy-6,9a-dimethyl-3-pyridin-2-yl-5,5a,6,9-tetrahydro-4H-benzo[g]indazole-8-carbonitrile is sourced from PubChem (CID 158603084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).