4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide

C167H183F24N19O9 — CID 158473989

About 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide

4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide (PubChem CID 158473989) has the molecular formula C167H183F24N19O9 and a molecular weight of 3056.38 g/mol. Its IUPAC name is 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide.

Molecular Properties

• Compound Name: 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide
• PubChem CID: 158473989
• Molecular Formula: C167H183F24N19O9
• Molecular Weight: 3056.38 g/mol
• Exact Mass: 3054.41
• IUPAC Name: 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide
• SMILES: COc1ccc(C(=O)Nc2ccc(-c3ccc(CN4CCN(Cc5ccncc5)CC4)cc3)cc2)cc1.COc1ccc(CC(=O)Nc2ccc(-c3ccc(CN4CCN(Cc5ccncc5)CC4)cc3)cc2)cc1.OC(c1ccc(-c2ccc(CN3CCN(CC4CCCN4)CC3)cc2)cc1)(C(F)(F)F)C(F)(F)F.OC(c1ccc(-c2ccc(CN3CCN(CC4CCCNC4)CC3)cc2)cc1)(C(F)(F)F)C(F)(F)F.OC(c1ccc(-c2ccc(CN3CCN(CC4CCNCC4)CC3)cc2)cc1)(C(F)(F)F)C(F)(F)F.Oc1ccc(CN2CCN(Cc3ccc(-c4ccc(C(O)(C(F)(F)F)C(F)(F)F)cc4)cc3)CC2)cc1
• InChI: InChI=1S/C32H34N4O2.C31H32N4O2.C27H26F6N2O2.2C26H31F6N3O.C25H29F6N3O/c1-38-31-12-4-25(5-13-31)22-32(37)34-30-10-8-29(9-11-30)28-6-2-26(3-7-28)23-35-18-20-36(21-19-35)24-27-14-16-33-17-15-27;1-37-30-12-8-28(9-13-30)31(36)33-29-10-6-27(7-11-29)26-4-2-24(3-5-26)22-34-18-20-35(21-19-34)23-25-14-16-32-17-15-25;28-26(29,30)25(37,27(31,32)33)23-9-7-22(8-10-23)21-5-1-19(2-6-21)17-34-13-15-35(16-14-34)18-20-3-11-24(36)12-4-20;27-25(28,29)24(36,26(30,31)32)23-7-5-22(6-8-23)21-3-1-19(2-4-21)17-34-13-15-35(16-14-34)18-20-9-11-33-12-10-20;27-25(28,29)24(36,26(30,31)32)23-9-7-22(8-10-23)21-5-3-19(4-6-21)17-34-12-14-35(15-13-34)18-20-2-1-11-33-16-20;26-24(27,28)23(35,25(29,30)31)21-9-7-20(8-10-21)19-5-3-18(4-6-19)16-33-12-14-34(15-13-33)17-22-2-1-11-32-22/h2-17H,18-24H2,1H3,(H,34,37);2-17H,18-23H2,1H3,(H,33,36);1-12,36-37H,13-18H2;1-8,20,33,36H,9-18H2;3-10,20,33,36H,1-2,11-18H2;3-10,22,32,35H,1-2,11-17H2
• InChIKey: HGRXMPYHEPRBBP-UHFFFAOYSA-N
• XLogP: 30.37
• TPSA: 278.56 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 26
• Rotatable Bonds: 41
• Heavy Atoms: 219
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3056.38
LogP ≤ 5	30.37
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide?

The IUPAC name of 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide (CID 158473989) is 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide.

What is the SMILES notation for 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide?

The canonical SMILES for 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide is COc1ccc(C(=O)Nc2ccc(-c3ccc(CN4CCN(Cc5ccncc5)CC4)cc3)cc2)cc1.COc1ccc(CC(=O)Nc2ccc(-c3ccc(CN4CCN(Cc5ccncc5)CC4)cc3)cc2)cc1.OC(c1ccc(-c2ccc(CN3CCN(CC4CCCN4)CC3)cc2)cc1)(C(F)(F)F)C(F)(F)F.OC(c1ccc(-c2ccc(CN3CCN(CC4CCCNC4)CC3)cc2)cc1)(C(F)(F)F)C(F)(F)F.OC(c1ccc(-c2ccc(CN3CCN(CC4CCNCC4)CC3)cc2)cc1)(C(F)(F)F)C(F)(F)F.Oc1ccc(CN2CCN(Cc3ccc(-c4ccc(C(O)(C(F)(F)F)C(F)(F)F)cc4)cc3)CC2)cc1.

What is the InChIKey of 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide?

The InChIKey is HGRXMPYHEPRBBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34N4O2.C31H32N4O2.C27H26F6N2O2.2C26H31F6N3O.C25H29F6N3O/c1-38-31-12-4-25(5-13-31)22-32(37)34-30-10-8-29(9-11-30)28-6-2-26(3-7-28)23-35-18-20-36(21-19-35)24-27-14-16-33-17-15-27;1-37-30-12-8-28(9-13-30)31(36)33-29-10-6-27(7-11-29)26-4-2-24(3-5-26)22-34-18-20-35(21-19-34)23-25-14-16-32-17-15-25;28-26(29,30)25(37,27(31,32)33)23-9-7-22(8-10-23)21-5-1-19(2-6-21)17-34-13-15-35(16-14-34)18-20-3-11-24(36)12-4-20;27-25(28,29)24(36,26(30,31)32)23-7-5-22(6-8-23)21-3-1-19(2-4-21)17-34-13-15-35(16-14-34)18-20-9-11-33-12-10-20;27-25(28,29)24(36,26(30,31)32)23-9-7-22(8-10-23)21-5-3-19(4-6-21)17-34-12-14-35(15-13-34)18-20-2-1-11-33-16-20;26-24(27,28)23(35,25(29,30)31)21-9-7-20(8-10-21)19-5-3-18(4-6-19)16-33-12-14-34(15-13-33)17-22-2-1-11-32-22/h2-17H,18-24H2,1H3,(H,34,37);2-17H,18-23H2,1H3,(H,33,36);1-12,36-37H,13-18H2;1-8,20,33,36H,9-18H2;3-10,20,33,36H,1-2,11-18H2;3-10,22,32,35H,1-2,11-17H2.

What are the key properties of 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide?

4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide has a molecular weight of 3056.38 g/mol, XLogP of 30.37, 41 rotatable bonds, 10 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[4-[[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]phenol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-3-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(piperidin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;1,1,1,3,3,3-hexafluoro-2-[4-[4-[[4-(pyrrolidin-2-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-ol;2-(4-methoxyphenyl)-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]acetamide;4-methoxy-N-[4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]benzamide is sourced from PubChem (CID 158473989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).