3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole

C97H93N23O5 — CID 158246325

About 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole

3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole (PubChem CID 158246325) has the molecular formula C97H93N23O5 and a molecular weight of 1660.97 g/mol. Its IUPAC name is 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole.

Molecular Properties

• Compound Name: 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole
• PubChem CID: 158246325
• Molecular Formula: C97H93N23O5
• Molecular Weight: 1660.97 g/mol
• Exact Mass: 1659.77
• IUPAC Name: 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole
• SMILES: C=C(c1ccccc1)c1cc(-c2c(C)noc2C)cc2[nH]c(N)nc12.Cc1n[nH]c(C)c1-c1cc(-c2c(C)noc2C)cc2[nH]c(N)nc12.Cc1nc2c(-c3c(C)cnn3C)cc(-c3c(C)noc3C)cc2[nH]1.Cc1nc2c(-c3cccc4ncccc34)cc(-c3c(C)noc3C)cc2[nH]1.Cc1noc(C)c1-c1cc(C(C)c2ccccc2)c2nc(N)[nH]c2c1
• InChI: InChI=1S/C22H18N4O.C20H20N4O.C20H18N4O.C18H19N5O.C17H18N6O/c1-12-21(13(2)27-26-12)15-10-18(22-20(11-15)24-14(3)25-22)16-6-4-8-19-17(16)7-5-9-23-19;2*1-11(14-7-5-4-6-8-14)16-9-15(18-12(2)24-25-13(18)3)10-17-19(16)23-20(21)22-17;1-9-8-19-23(5)18(9)14-6-13(16-10(2)22-24-11(16)3)7-15-17(14)21-12(4)20-15;1-7-14(8(2)22-21-7)12-5-11(15-9(3)23-24-10(15)4)6-13-16(12)20-17(18)19-13/h4-11H,1-3H3,(H,24,25);4-11H,1-3H3,(H3,21,22,23);4-10H,1H2,2-3H3,(H3,21,22,23);6-8H,1-5H3,(H,20,21);5-6H,1-4H3,(H,21,22)(H3,18,19,20)
• InChIKey: GGDTVWQFCBFNJB-UHFFFAOYSA-N
• XLogP: 21.68
• TPSA: 411.00 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 22
• Rotatable Bonds: 12
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1660.97
LogP ≤ 5	21.68
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole?

The IUPAC name of 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole (CID 158246325) is 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole.

What is the SMILES notation for 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole?

The canonical SMILES for 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole is C=C(c1ccccc1)c1cc(-c2c(C)noc2C)cc2[nH]c(N)nc12.Cc1n[nH]c(C)c1-c1cc(-c2c(C)noc2C)cc2[nH]c(N)nc12.Cc1nc2c(-c3c(C)cnn3C)cc(-c3c(C)noc3C)cc2[nH]1.Cc1nc2c(-c3cccc4ncccc34)cc(-c3c(C)noc3C)cc2[nH]1.Cc1noc(C)c1-c1cc(C(C)c2ccccc2)c2nc(N)[nH]c2c1.

What is the InChIKey of 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole?

The InChIKey is GGDTVWQFCBFNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O.C20H20N4O.C20H18N4O.C18H19N5O.C17H18N6O/c1-12-21(13(2)27-26-12)15-10-18(22-20(11-15)24-14(3)25-22)16-6-4-8-19-17(16)7-5-9-23-19;2*1-11(14-7-5-4-6-8-14)16-9-15(18-12(2)24-25-13(18)3)10-17-19(16)23-20(21)22-17;1-9-8-19-23(5)18(9)14-6-13(16-10(2)22-24-11(16)3)7-15-17(14)21-12(4)20-15;1-7-14(8(2)22-21-7)12-5-11(15-9(3)23-24-10(15)4)6-13-16(12)20-17(18)19-13/h4-11H,1-3H3,(H,24,25);4-11H,1-3H3,(H3,21,22,23);4-10H,1H2,2-3H3,(H3,21,22,23);6-8H,1-5H3,(H,20,21);5-6H,1-4H3,(H,21,22)(H3,18,19,20).

What are the key properties of 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole?

3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole has a molecular weight of 1660.97 g/mol, XLogP of 21.68, 12 rotatable bonds, 9 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-dimethyl-4-(2-methyl-7-quinolin-5-yl-3H-benzimidazol-5-yl)-1,2-oxazole;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3,5-dimethyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethenyl)-1H-benzimidazol-2-amine;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1-phenylethyl)-1H-benzimidazol-2-amine;4-[7-(1,4-dimethylpyrazol-5-yl)-2-methyl-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole is sourced from PubChem (CID 158246325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).