2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine

C42H30Cl4N4 — CID 69350362

IUPAC2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine
SMILESClc1ccc(C2(c3ccc(Cl)cc3Cl)NC(c3ccccc3)(c3ccccc3)C(c3ccccc3)(c3ccccc3)N2c2ncc[nH]2)c(Cl)c1
InChIInChI=1S/C42H30Cl4N4/c43-33-21-23-35(37(45)27-33)42(36-24-22-34(44)28-38(36)46)49-40(29-13-5-1-6-14-29,30-15-7-2-8-16-30)41(31-17-9-3-10-18-31,32-19-11-4-12-20-32)50(42)39-47-25-26-48-39/h1-28,49H,(H,47,48)
InChIKeyRWTAHVFUFBYBPW-UHFFFAOYSA-N
MW732.54 g/mol
LogP11.22
Rot. Bonds7

About 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine

2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine (PubChem CID 69350362) has the molecular formula C42H30Cl4N4 and a molecular weight of 732.54 g/mol. Its IUPAC name is 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine.

Molecular Properties

Compound Name2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine
PubChem CID69350362
Molecular FormulaC42H30Cl4N4
Molecular Weight732.54 g/mol
Exact Mass730.12
IUPAC Name2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine
SMILESClc1ccc(C2(c3ccc(Cl)cc3Cl)NC(c3ccccc3)(c3ccccc3)C(c3ccccc3)(c3ccccc3)N2c2ncc[nH]2)c(Cl)c1
InChIInChI=1S/C42H30Cl4N4/c43-33-21-23-35(37(45)27-33)42(36-24-22-34(44)28-38(36)46)49-40(29-13-5-1-6-14-29,30-15-7-2-8-16-30)41(31-17-9-3-10-18-31,32-19-11-4-12-20-32)50(42)39-47-25-26-48-39/h1-28,49H,(H,47,48)
InChIKeyRWTAHVFUFBYBPW-UHFFFAOYSA-N
XLogP11.22
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500732.54
LogP ≤ 511.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine?
The IUPAC name of 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine (CID 69350362) is 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine.
What is the SMILES notation for 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine?
The canonical SMILES for 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine is Clc1ccc(C2(c3ccc(Cl)cc3Cl)NC(c3ccccc3)(c3ccccc3)C(c3ccccc3)(c3ccccc3)N2c2ncc[nH]2)c(Cl)c1.
What is the InChIKey of 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine?
The InChIKey is RWTAHVFUFBYBPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H30Cl4N4/c43-33-21-23-35(37(45)27-33)42(36-24-22-34(44)28-38(36)46)49-40(29-13-5-1-6-14-29,30-15-7-2-8-16-30)41(31-17-9-3-10-18-31,32-19-11-4-12-20-32)50(42)39-47-25-26-48-39/h1-28,49H,(H,47,48).
What are the key properties of 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine?
2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine has a molecular weight of 732.54 g/mol, XLogP of 11.22, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(2,4-dichlorophenyl)-1-(1H-imidazol-2-yl)-4,4,5,5-tetraphenylimidazolidine is sourced from PubChem (CID 69350362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).