1-[2-(cyclohexen-1-yl)ethyl]-3-[2-(1H-indol-3-yl)-2-oxoethyl]imidazolidine-2,4,5-trione

HCID 9268763

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Basic information

CAS: 923904-91-0
Standard SMILES: O=C(CN1C(=O)C(=O)N(CCC2=CCCCC2)C1=O)c1c[nH]c2ccccc12
InChIKey: DYVKEULWSDQRGS-UHFFFAOYSA-N
Molecular formula: C21H21N3O4
Average molar mass: 379.4 g/mol
Monoisotopic mass: 379.15320616

Names & identifiers

Preferred name: 1-[2-(cyclohexen-1-yl)ethyl]-3-[2-(1H-indol-3-yl)-2-oxoethyl]imidazolidine-2,4,5-trione
IUPAC: 1-[2-(cyclohexen-1-yl)ethyl]-3-[2-(1H-indol-3-yl)-2-oxoethyl]imidazolidine-2,4,5-trione

Names & synonyms

MLS002245002CHEMBL1715109DTXSID801331692HMS3048A14AKOS0339608911-[2-(cyclohexen-1-yl)ethyl]-3-[2-(1H-indol-3-yl)-2-oxoethyl]imidazolidine-2,4,5-trione1-(2-(1H-Indol-3-yl)-2-oxoethyl)-3-(2-(cyclohex-1-en-1-yl)ethyl)imidazolidine-2,4,5-trioneSMR001308670Z263215941-[2-(cyclohex-1-en-1-yl)ethyl]-3-[2-(1H-indol-3-yl)-2-oxoethyl]imidazolidine-2,4,5-trione923904-91-0

Database identifiers

CAS: 923904-91-0
PubChem CID: 9268763
DTXSID: DTXSID801331692
ChEMBL: CHEMBL1715109

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 90.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 6
Heavy atoms: 28
Formal charge: 0
Complexity: 716

Experimental & physicochemical properties

Solubility3.2 [ug/mL] (The mean of the results at pH 7.4)

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