5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione

C20H15Cl2N3O2S — CID 24592742

About 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione

5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione (PubChem CID 24592742) has the molecular formula C20H15Cl2N3O2S and a molecular weight of 432.33 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione.

Molecular Properties

• Compound Name: 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione
• PubChem CID: 24592742
• Molecular Formula: C20H15Cl2N3O2S
• Molecular Weight: 432.33 g/mol
• Exact Mass: 431.03
• IUPAC Name: 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione
• SMILES: CC1(c2ccc(Cl)cc2)NC(=O)N(Cc2csc(-c3ccccc3Cl)n2)C1=O
• InChI: InChI=1S/C20H15Cl2N3O2S/c1-20(12-6-8-13(21)9-7-12)18(26)25(19(27)24-20)10-14-11-28-17(23-14)15-4-2-3-5-16(15)22/h2-9,11H,10H2,1H3,(H,24,27)
• InChIKey: BLBZYBWPASCYGL-UHFFFAOYSA-N
• XLogP: 5.08
• TPSA: 62.30 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	432.33
LogP ≤ 5	5.08
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione?

The IUPAC name of 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione (CID 24592742) is 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione.

What is the SMILES notation for 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione?

The canonical SMILES for 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione is CC1(c2ccc(Cl)cc2)NC(=O)N(Cc2csc(-c3ccccc3Cl)n2)C1=O.

What is the InChIKey of 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione?

The InChIKey is BLBZYBWPASCYGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2N3O2S/c1-20(12-6-8-13(21)9-7-12)18(26)25(19(27)24-20)10-14-11-28-17(23-14)15-4-2-3-5-16(15)22/h2-9,11H,10H2,1H3,(H,24,27).

What are the key properties of 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione?

5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione has a molecular weight of 432.33 g/mol, XLogP of 5.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-chlorophenyl)-3-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 24592742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).