5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione

C27H24N4O5 — CID 38827168

IUPAC5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione
SMILESCOc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(Cc3nnc(-c4ccc(C)cc4)o3)C2=O)cc1
InChIInChI=1S/C27H24N4O5/c1-17-4-6-18(7-5-17)24-30-29-23(36-24)16-31-25(32)27(28-26(31)33,19-8-12-21(34-2)13-9-19)20-10-14-22(35-3)15-11-20/h4-15H,16H2,1-3H3,(H,28,33)
InChIKeyRKYRWCWUYXAXRY-UHFFFAOYSA-N
MW484.51 g/mol
LogP4.06
Rot. Bonds7

About 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione

5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione (PubChem CID 38827168) has the molecular formula C27H24N4O5 and a molecular weight of 484.51 g/mol. Its IUPAC name is 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione
PubChem CID38827168
Molecular FormulaC27H24N4O5
Molecular Weight484.51 g/mol
Exact Mass484.17
IUPAC Name5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione
SMILESCOc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(Cc3nnc(-c4ccc(C)cc4)o3)C2=O)cc1
InChIInChI=1S/C27H24N4O5/c1-17-4-6-18(7-5-17)24-30-29-23(36-24)16-31-25(32)27(28-26(31)33,19-8-12-21(34-2)13-9-19)20-10-14-22(35-3)15-11-20/h4-15H,16H2,1-3H3,(H,28,33)
InChIKeyRKYRWCWUYXAXRY-UHFFFAOYSA-N
XLogP4.06
TPSA106.79 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.51
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

3-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 47094602
(5S)-5-(6-methoxynaphthalen-2-yl)-5-methyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]imidazolidine-2,4-dione
CID 41157193
(5S)-5-(furan-2-yl)-3-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-methylimidazolidine-2,4-dione
CID 92786731
(5R)-5-(3-bromophenyl)-3-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-methylimidazolidine-2,4-dione
CID 92786945
4-[4-methyl-1-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-2,5-dioxoimidazolidin-4-yl]benzonitrile
CID 55602325
(5R)-5-methyl-3-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 41144059
3-[(4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 16577297
4-[[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]methyl]benzonitrile
CID 2121699
5,5-bis(4-methoxyphenyl)-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione
CID 2090016
N-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-N-methyl-2-(4-methylphenoxy)ethanamine
CID 34722034
5-(4-chlorophenyl)-5-methyl-3-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione
CID 112787554
5-ethyl-3-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-phenylimidazolidine-2,4-dione
CID 17405120

Frequently Asked Questions

What is the IUPAC name of 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione (CID 38827168) is 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione is COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(Cc3nnc(-c4ccc(C)cc4)o3)C2=O)cc1.
What is the InChIKey of 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione?
The InChIKey is RKYRWCWUYXAXRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N4O5/c1-17-4-6-18(7-5-17)24-30-29-23(36-24)16-31-25(32)27(28-26(31)33,19-8-12-21(34-2)13-9-19)20-10-14-22(35-3)15-11-20/h4-15H,16H2,1-3H3,(H,28,33).
What are the key properties of 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione?
5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione has a molecular weight of 484.51 g/mol, XLogP of 4.06, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-bis(4-methoxyphenyl)-3-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 38827168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).