(5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione

C16H10Cl2N2O2 — CID 6366598

IUPAC(5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione
SMILESO=C1N/C(=C\c2ccc(Cl)cc2)C(=O)N1c1ccc(Cl)cc1
InChIInChI=1S/C16H10Cl2N2O2/c17-11-3-1-10(2-4-11)9-14-15(21)20(16(22)19-14)13-7-5-12(18)6-8-13/h1-9H,(H,19,22)/b14-9-
InChIKeyLJRYXMIJFNSUBY-ZROIWOOFSA-N
MW333.17 g/mol
LogP4.09
Rot. Bonds2

About (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione

(5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione (PubChem CID 6366598) has the molecular formula C16H10Cl2N2O2 and a molecular weight of 333.17 g/mol. Its IUPAC name is (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione
PubChem CID6366598
Molecular FormulaC16H10Cl2N2O2
Molecular Weight333.17 g/mol
Exact Mass332.01
IUPAC Name(5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione
SMILESO=C1N/C(=C\c2ccc(Cl)cc2)C(=O)N1c1ccc(Cl)cc1
InChIInChI=1S/C16H10Cl2N2O2/c17-11-3-1-10(2-4-11)9-14-15(21)20(16(22)19-14)13-7-5-12(18)6-8-13/h1-9H,(H,19,22)/b14-9-
InChIKeyLJRYXMIJFNSUBY-ZROIWOOFSA-N
XLogP4.09
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.17
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione?
The IUPAC name of (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione (CID 6366598) is (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione?
The canonical SMILES for (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione is O=C1N/C(=C\c2ccc(Cl)cc2)C(=O)N1c1ccc(Cl)cc1.
What is the InChIKey of (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione?
The InChIKey is LJRYXMIJFNSUBY-ZROIWOOFSA-N. The full InChI is InChI=1S/C16H10Cl2N2O2/c17-11-3-1-10(2-4-11)9-14-15(21)20(16(22)19-14)13-7-5-12(18)6-8-13/h1-9H,(H,19,22)/b14-9-.
What are the key properties of (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione?
(5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione has a molecular weight of 333.17 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-3-(4-chlorophenyl)-5-[(4-chlorophenyl)methylidene]imidazolidine-2,4-dione is sourced from PubChem (CID 6366598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).