4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide

C24H19N3O3 — CID 7897314

IUPAC4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(CN2C(=O)N/C(=C\c3ccccc3)C2=O)cc1
InChIInChI=1S/C24H19N3O3/c28-22(25-20-9-5-2-6-10-20)19-13-11-18(12-14-19)16-27-23(29)21(26-24(27)30)15-17-7-3-1-4-8-17/h1-15H,16H2,(H,25,28)(H,26,30)/b21-15-
InChIKeyHMFVCTZLFYEDEB-QNGOZBTKSA-N
MW397.43 g/mol
LogP4.03
Rot. Bonds5

About 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide

4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide (PubChem CID 7897314) has the molecular formula C24H19N3O3 and a molecular weight of 397.43 g/mol. Its IUPAC name is 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide.

Molecular Properties

Compound Name4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide
PubChem CID7897314
Molecular FormulaC24H19N3O3
Molecular Weight397.43 g/mol
Exact Mass397.14
IUPAC Name4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(CN2C(=O)N/C(=C\c3ccccc3)C2=O)cc1
InChIInChI=1S/C24H19N3O3/c28-22(25-20-9-5-2-6-10-20)19-13-11-18(12-14-19)16-27-23(29)21(26-24(27)30)15-17-7-3-1-4-8-17/h1-15H,16H2,(H,25,28)(H,26,30)/b21-15-
InChIKeyHMFVCTZLFYEDEB-QNGOZBTKSA-N
XLogP4.03
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.43
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-(4-fluorophenyl)benzamide
CID 18873943
4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 18873952
4-[(1,3-dioxoisoindol-2-yl)methyl]-N-phenylbenzamide
CID 2995396
2-[(4Z)-4-[(4-chlorophenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide
CID 19256098
methyl 4-[(E)-[1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]benzoate
CID 6377358
methyl 4-[(E)-[1-[(4-bromophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]benzoate
CID 6375905
(5E)-5-benzylidene-3-phenacylimidazolidine-2,4-dione
CID 177488195
2-[4-[[4-(4-chlorophenyl)phenyl]methylidene]-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide
CID 77425794
3-[(4-bromophenyl)methyl]-5-[(4-bromophenyl)methylidene]imidazolidine-2,4-dione
CID 3656604
4-[[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide
CID 4877614
ethyl 4-[[2-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]acetyl]amino]benzoate
CID 16632824
(5E)-3-benzyl-5-[[4-(dimethylamino)phenyl]methylidene]imidazolidine-2,4-dione
CID 68648545

Frequently Asked Questions

What is the IUPAC name of 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide?
The IUPAC name of 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide (CID 7897314) is 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide.
What is the SMILES notation for 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide?
The canonical SMILES for 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccc(CN2C(=O)N/C(=C\c3ccccc3)C2=O)cc1.
What is the InChIKey of 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide?
The InChIKey is HMFVCTZLFYEDEB-QNGOZBTKSA-N. The full InChI is InChI=1S/C24H19N3O3/c28-22(25-20-9-5-2-6-10-20)19-13-11-18(12-14-19)16-27-23(29)21(26-24(27)30)15-17-7-3-1-4-8-17/h1-15H,16H2,(H,25,28)(H,26,30)/b21-15-.
What are the key properties of 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide?
4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide has a molecular weight of 397.43 g/mol, XLogP of 4.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide is sourced from PubChem (CID 7897314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).