4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one

C171H180F12N12O20 — CID 158441359

About 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one

4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one (PubChem CID 158441359) has the molecular formula C171H180F12N12O20 and a molecular weight of 2951.36 g/mol. Its IUPAC name is 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one.

Molecular Properties

• Compound Name: 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one
• PubChem CID: 158441359
• Molecular Formula: C171H180F12N12O20
• Molecular Weight: 2951.36 g/mol
• Exact Mass: 2949.32
• IUPAC Name: 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one
• SMILES: COc1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3)n(Cc3ccc(C(=O)CCCOCCOCCN)cc3)c2-c2ccc(OC)c(C)c2)cc1C.COc1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)n(Cc3ccc(C(=O)CCCOCCOCCN)cc3)c2-c2ccc(OC)c(C)c2)cc1C.COc1ccc(-c2nc(-c3ccc4c(c3)-c3ccccc3C4)n(Cc3ccc(C(=O)CCCOCCOCCN)cc3)c2-c2ccc(OC)c(C)c2)cc1C.COc1ccc(-c2nc(-c3cccc(C(F)(F)F)c3)n(Cc3ccc(C(=O)CCCOCCOCCN)cc3)c2-c2ccc(OC)c(C)c2)cc1C
• InChI: InChI=1S/C47H49N3O5.C42H43F6N3O5.2C41H44F3N3O5/c1-31-26-37(17-19-43(31)52-3)45-46(38-18-20-44(53-4)32(2)27-38)50(47(49-45)39-16-15-36-28-35-8-5-6-9-40(35)41(36)29-39)30-33-11-13-34(14-12-33)42(51)10-7-22-54-24-25-55-23-21-48;1-26-22-30(11-15-36(26)53-3)38-39(31-12-16-37(54-4)27(2)23-31)51(40(50-38)33-14-13-32(41(43,44)45)24-34(33)42(46,47)48)25-28-7-9-29(10-8-28)35(52)6-5-18-55-20-21-56-19-17-49;1-27-23-31(14-16-36(27)49-3)38-39(32-15-17-37(50-4)28(2)24-32)47(40(46-38)33-7-5-8-34(25-33)41(42,43)44)26-29-10-12-30(13-11-29)35(48)9-6-19-51-21-22-52-20-18-45;1-27-24-32(13-17-36(27)49-3)38-39(33-14-18-37(50-4)28(2)25-33)47(40(46-38)31-11-15-34(16-12-31)41(42,43)44)26-29-7-9-30(10-8-29)35(48)6-5-20-51-22-23-52-21-19-45/h5-6,8-9,11-20,26-27,29H,7,10,21-25,28,30,48H2,1-4H3;7-16,22-24H,5-6,17-21,25,49H2,1-4H3;5,7-8,10-17,23-25H,6,9,18-22,26,45H2,1-4H3;7-18,24-25H,5-6,19-23,26,45H2,1-4H3
• InChIKey: HCVWMBLUSMHFSF-UHFFFAOYSA-N
• XLogP: 35.73
• TPSA: 391.32 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 32
• Rotatable Bonds: 68
• Heavy Atoms: 215
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2951.36
LogP ≤ 5	35.73
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one?

The IUPAC name of 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one (CID 158441359) is 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one.

What is the SMILES notation for 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one?

The canonical SMILES for 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one is COc1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3)n(Cc3ccc(C(=O)CCCOCCOCCN)cc3)c2-c2ccc(OC)c(C)c2)cc1C.COc1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)n(Cc3ccc(C(=O)CCCOCCOCCN)cc3)c2-c2ccc(OC)c(C)c2)cc1C.COc1ccc(-c2nc(-c3ccc4c(c3)-c3ccccc3C4)n(Cc3ccc(C(=O)CCCOCCOCCN)cc3)c2-c2ccc(OC)c(C)c2)cc1C.COc1ccc(-c2nc(-c3cccc(C(F)(F)F)c3)n(Cc3ccc(C(=O)CCCOCCOCCN)cc3)c2-c2ccc(OC)c(C)c2)cc1C.

What is the InChIKey of 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one?

The InChIKey is HCVWMBLUSMHFSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H49N3O5.C42H43F6N3O5.2C41H44F3N3O5/c1-31-26-37(17-19-43(31)52-3)45-46(38-18-20-44(53-4)32(2)27-38)50(47(49-45)39-16-15-36-28-35-8-5-6-9-40(35)41(36)29-39)30-33-11-13-34(14-12-33)42(51)10-7-22-54-24-25-55-23-21-48;1-26-22-30(11-15-36(26)53-3)38-39(31-12-16-37(54-4)27(2)23-31)51(40(50-38)33-14-13-32(41(43,44)45)24-34(33)42(46,47)48)25-28-7-9-29(10-8-28)35(52)6-5-18-55-20-21-56-19-17-49;1-27-23-31(14-16-36(27)49-3)38-39(32-15-17-37(50-4)28(2)24-32)47(40(46-38)33-7-5-8-34(25-33)41(42,43)44)26-29-10-12-30(13-11-29)35(48)9-6-19-51-21-22-52-20-18-45;1-27-24-32(13-17-36(27)49-3)38-39(33-14-18-37(50-4)28(2)25-33)47(40(46-38)31-11-15-34(16-12-31)41(42,43)44)26-29-7-9-30(10-8-29)35(48)6-5-20-51-22-23-52-21-19-45/h5-6,8-9,11-20,26-27,29H,7,10,21-25,28,30,48H2,1-4H3;7-16,22-24H,5-6,17-21,25,49H2,1-4H3;5,7-8,10-17,23-25H,6,9,18-22,26,45H2,1-4H3;7-18,24-25H,5-6,19-23,26,45H2,1-4H3.

What are the key properties of 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one?

4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one has a molecular weight of 2951.36 g/mol, XLogP of 35.73, 68 rotatable bonds, 4 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[3-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[4,5-bis(4-methoxy-3-methylphenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one;4-[2-(2-aminoethoxy)ethoxy]-1-[4-[[2-(9H-fluoren-3-yl)-4,5-bis(4-methoxy-3-methylphenyl)imidazol-1-yl]methyl]phenyl]butan-1-one is sourced from PubChem (CID 158441359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).