4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

C20H16N4O3S — CID 75468274

IUPAC4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCC1(c2ccc(C(=O)Nc3nc(-c4ccccc4)cs3)cc2)NC(=O)NC1=O
InChIInChI=1S/C20H16N4O3S/c1-20(17(26)23-18(27)24-20)14-9-7-13(8-10-14)16(25)22-19-21-15(11-28-19)12-5-3-2-4-6-12/h2-11H,1H3,(H,21,22,25)(H2,23,24,26,27)
InChIKeyXEZLDBVQZGSQDK-UHFFFAOYSA-N
MW392.44 g/mol
LogP3.12
Rot. Bonds4

About 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (PubChem CID 75468274) has the molecular formula C20H16N4O3S and a molecular weight of 392.44 g/mol. Its IUPAC name is 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
PubChem CID75468274
Molecular FormulaC20H16N4O3S
Molecular Weight392.44 g/mol
Exact Mass392.09
IUPAC Name4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCC1(c2ccc(C(=O)Nc3nc(-c4ccccc4)cs3)cc2)NC(=O)NC1=O
InChIInChI=1S/C20H16N4O3S/c1-20(17(26)23-18(27)24-20)14-9-7-13(8-10-14)16(25)22-19-21-15(11-28-19)12-5-3-2-4-6-12/h2-11H,1H3,(H,21,22,25)(H2,23,24,26,27)
InChIKeyXEZLDBVQZGSQDK-UHFFFAOYSA-N
XLogP3.12
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.44
LogP ≤ 53.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-bromo-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 988802
4-acetamido-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 2463728
4-chloro-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 2332435
N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-4-phenylbenzamide
CID 3308072
N-[4-(2-benzamido-1,3-thiazol-4-yl)-1,3-thiazol-2-yl]benzamide
CID 4294892
N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
CID 17417127
2-oxo-N-(4-phenyl-1,3-thiazol-2-yl)-1,3-dihydroindole-5-carboxamide
CID 108797869
N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-4-phenylbenzamide
CID 3120660
9-oxo-N-(4-phenyl-1,3-thiazol-2-yl)fluorene-2-carboxamide
CID 16613201
1,3-bis(4-phenyl-1,3-thiazol-2-yl)urea
CID 13089293
N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-phenylacetyl)benzamide
CID 19176230
4-pentoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 4114659

Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (CID 75468274) is 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is CC1(c2ccc(C(=O)Nc3nc(-c4ccccc4)cs3)cc2)NC(=O)NC1=O.
What is the InChIKey of 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is XEZLDBVQZGSQDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O3S/c1-20(17(26)23-18(27)24-20)14-9-7-13(8-10-14)16(25)22-19-21-15(11-28-19)12-5-3-2-4-6-12/h2-11H,1H3,(H,21,22,25)(H2,23,24,26,27).
What are the key properties of 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 392.44 g/mol, XLogP of 3.12, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 75468274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).