[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone

C118H103F5N24O10 — CID 158384302

About [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone

[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone (PubChem CID 158384302) has the molecular formula C118H103F5N24O10 and a molecular weight of 2112.27 g/mol. Its IUPAC name is [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone.

Molecular Properties

• Compound Name: [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone
• PubChem CID: 158384302
• Molecular Formula: C118H103F5N24O10
• Molecular Weight: 2112.27 g/mol
• Exact Mass: 2110.82
• IUPAC Name: [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone
• SMILES: Cc1cc(C(=O)c2cc(-c3c(C)noc3C)cc3[nH]c(C4CC4)nc23)c(C)cn1.Cc1cnccc1C(O)(c1ccncc1C)c1cc(-c2c(C)noc2C)cc2[nH]c(C3CC3)nc12.Cc1noc(C)c1-c1cc(C(=O)c2ccc(C(F)(F)F)nn2)c2nc(C3CC3)[nH]c2c1.Cc1noc(C)c1-c1cc(C(=O)c2cccnn2)c2nc(C3CC3)[nH]c2c1.Cc1noc(C)c1-c1cc(C(O)(c2ccc(F)cn2)c2ccc(F)cn2)c2nc(C3CC3)[nH]c2c1
• InChI: InChI=1S/C28H27N5O2.C26H21F2N5O2.C23H22N4O2.C21H16F3N5O2.C20H17N5O2/c1-15-13-29-9-7-21(15)28(34,22-8-10-30-14-16(22)2)23-11-20(25-17(3)33-35-18(25)4)12-24-26(23)32-27(31-24)19-5-6-19;1-13-23(14(2)35-33-13)16-9-19(24-20(10-16)31-25(32-24)15-3-4-15)26(34,21-7-5-17(27)11-29-21)22-8-6-18(28)12-30-22;1-11-10-24-12(2)7-17(11)22(28)18-8-16(20-13(3)27-29-14(20)4)9-19-21(18)26-23(25-19)15-5-6-15;1-9-17(10(2)31-29-9)12-7-13(18-15(8-12)25-20(26-18)11-3-4-11)19(30)14-5-6-16(28-27-14)21(22,23)24;1-10-17(11(2)27-25-10)13-8-14(19(26)15-4-3-7-21-24-15)18-16(9-13)22-20(23-18)12-5-6-12/h7-14,19,34H,5-6H2,1-4H3,(H,31,32);5-12,15,34H,3-4H2,1-2H3,(H,31,32);7-10,15H,5-6H2,1-4H3,(H,25,26);5-8,11H,3-4H2,1-2H3,(H,25,26);3-4,7-9,12H,5-6H2,1-2H3,(H,22,23)
• InChIKey: GWELNDPLEZHWFI-UHFFFAOYSA-N
• XLogP: 23.91
• TPSA: 481.23 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 29
• Rotatable Bonds: 22
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2112.27
LogP ≤ 5	23.91
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone?

The IUPAC name of [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone (CID 158384302) is [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone.

What is the SMILES notation for [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone?

The canonical SMILES for [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone is Cc1cc(C(=O)c2cc(-c3c(C)noc3C)cc3[nH]c(C4CC4)nc23)c(C)cn1.Cc1cnccc1C(O)(c1ccncc1C)c1cc(-c2c(C)noc2C)cc2[nH]c(C3CC3)nc12.Cc1noc(C)c1-c1cc(C(=O)c2ccc(C(F)(F)F)nn2)c2nc(C3CC3)[nH]c2c1.Cc1noc(C)c1-c1cc(C(=O)c2cccnn2)c2nc(C3CC3)[nH]c2c1.Cc1noc(C)c1-c1cc(C(O)(c2ccc(F)cn2)c2ccc(F)cn2)c2nc(C3CC3)[nH]c2c1.

What is the InChIKey of [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone?

The InChIKey is GWELNDPLEZHWFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27N5O2.C26H21F2N5O2.C23H22N4O2.C21H16F3N5O2.C20H17N5O2/c1-15-13-29-9-7-21(15)28(34,22-8-10-30-14-16(22)2)23-11-20(25-17(3)33-35-18(25)4)12-24-26(23)32-27(31-24)19-5-6-19;1-13-23(14(2)35-33-13)16-9-19(24-20(10-16)31-25(32-24)15-3-4-15)26(34,21-7-5-17(27)11-29-21)22-8-6-18(28)12-30-22;1-11-10-24-12(2)7-17(11)22(28)18-8-16(20-13(3)27-29-14(20)4)9-19-21(18)26-23(25-19)15-5-6-15;1-9-17(10(2)31-29-9)12-7-13(18-15(8-12)25-20(26-18)11-3-4-11)19(30)14-5-6-16(28-27-14)21(22,23)24;1-10-17(11(2)27-25-10)13-8-14(19(26)15-4-3-7-21-24-15)18-16(9-13)22-20(23-18)12-5-6-12/h7-14,19,34H,5-6H2,1-4H3,(H,31,32);5-12,15,34H,3-4H2,1-2H3,(H,31,32);7-10,15H,5-6H2,1-4H3,(H,25,26);5-8,11H,3-4H2,1-2H3,(H,25,26);3-4,7-9,12H,5-6H2,1-2H3,(H,22,23).

What are the key properties of [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone?

[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone has a molecular weight of 2112.27 g/mol, XLogP of 23.91, 22 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for [2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(5-fluoro-2-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-bis(3-methyl-4-pyridinyl)methanol;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-(2,5-dimethyl-4-pyridinyl)methanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-pyridazin-3-ylmethanone;[2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-4-yl]-[6-(trifluoromethyl)pyridazin-3-yl]methanone is sourced from PubChem (CID 158384302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).