2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one

C34H28Cl2N4O2S2 — CID 139224957

About 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one

2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one (PubChem CID 139224957) has the molecular formula C34H28Cl2N4O2S2 and a molecular weight of 659.66 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one.

Molecular Properties

• Compound Name: 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one
• PubChem CID: 139224957
• Molecular Formula: C34H28Cl2N4O2S2
• Molecular Weight: 659.66 g/mol
• Exact Mass: 658.10
• IUPAC Name: 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one
• SMILES: O=C1CSC(c2ccccc2Cl)N1c1cccc(CN2CCN=C2c2cccc(N3C(=O)CSC3c3ccccc3Cl)c2)c1
• InChI: InChI=1S/C34H28Cl2N4O2S2/c35-28-13-3-1-11-26(28)33-39(30(41)20-43-33)24-9-5-7-22(17-24)19-38-16-15-37-32(38)23-8-6-10-25(18-23)40-31(42)21-44-34(40)27-12-2-4-14-29(27)36/h1-14,17-18,33-34H,15-16,19-21H2
• InChIKey: CADVRBXYOYYGQU-UHFFFAOYSA-N
• XLogP: 7.81
• TPSA: 56.22 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	659.66
LogP ≤ 5	7.81
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one?

The IUPAC name of 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one (CID 139224957) is 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one.

What is the SMILES notation for 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one?

The canonical SMILES for 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one is O=C1CSC(c2ccccc2Cl)N1c1cccc(CN2CCN=C2c2cccc(N3C(=O)CSC3c3ccccc3Cl)c2)c1.

What is the InChIKey of 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one?

The InChIKey is CADVRBXYOYYGQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28Cl2N4O2S2/c35-28-13-3-1-11-26(28)33-39(30(41)20-43-33)24-9-5-7-22(17-24)19-38-16-15-37-32(38)23-8-6-10-25(18-23)40-31(42)21-44-34(40)27-12-2-4-14-29(27)36/h1-14,17-18,33-34H,15-16,19-21H2.

What are the key properties of 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one?

2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one has a molecular weight of 659.66 g/mol, XLogP of 7.81, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-chlorophenyl)-3-[3-[[2-[3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]phenyl]-4,5-dihydroimidazol-1-yl]methyl]phenyl]-1,3-thiazolidin-4-one is sourced from PubChem (CID 139224957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).