2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one

C18H16Cl2N2O2 — CID 136896249

IUPAC2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one
SMILESCC(C)C1N=C(c2cc(Cl)ccc2O)N(c2cccc(Cl)c2)C1=O
InChIInChI=1S/C18H16Cl2N2O2/c1-10(2)16-18(24)22(13-5-3-4-11(19)8-13)17(21-16)14-9-12(20)6-7-15(14)23/h3-10,16,23H,1-2H3
InChIKeyGXRLRVGVBVHIRB-UHFFFAOYSA-N
MW363.24 g/mol
LogP4.52
Rot. Bonds3

About 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one

2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one (PubChem CID 136896249) has the molecular formula C18H16Cl2N2O2 and a molecular weight of 363.24 g/mol. Its IUPAC name is 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one.

Molecular Properties

Compound Name2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one
PubChem CID136896249
Molecular FormulaC18H16Cl2N2O2
Molecular Weight363.24 g/mol
Exact Mass362.06
IUPAC Name2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one
SMILESCC(C)C1N=C(c2cc(Cl)ccc2O)N(c2cccc(Cl)c2)C1=O
InChIInChI=1S/C18H16Cl2N2O2/c1-10(2)16-18(24)22(13-5-3-4-11(19)8-13)17(21-16)14-9-12(20)6-7-15(14)23/h3-10,16,23H,1-2H3
InChIKeyGXRLRVGVBVHIRB-UHFFFAOYSA-N
XLogP4.52
TPSA52.90 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.24
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-chlorophenyl)-1,2,4-triazole-3,5-dione
CID 15179076
1-(3-chlorophenyl)-3-methylpyrrolidine-2,5-dione
CID 71519662
4-(3-chlorophenyl)-10-propan-2-ylidene-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 4112984
(1R,2R,6R,7S)-4-(3-chlorophenyl)-10-propan-2-ylidene-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 26975220
1-(3-chlorophenyl)-4-hydroxy-6-oxopyridazine-3-carboxamide
CID 54687297
(3R,3aR,6aS)-5-(3-chlorophenyl)-3-methyl-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione
CID 7290040
5-tert-butyl-4-[(5-chloro-2-hydroxyphenyl)iminomethyl]-2-(3-chlorophenyl)-4H-pyrazol-3-one
CID 170398327
1-(5-chloro-2-hydroxyphenyl)-3,4-dimethylpyrrolidine-2,5-dione
CID 20727648
3-(3-chlorophenyl)-6,6-diphenyl-3-azabicyclo[3.1.0]hexane-2,4-dione
CID 3713625
(5E)-5-[(5-chloro-2-hydroxyphenyl)methylidene]-3-(3-chlorophenyl)imidazolidine-2,4-dione
CID 126100759
3-(3-chlorophenyl)-4-hydroxy-5-propan-2-yl-1H-imidazol-2-one
CID 91265163
1-(3-chlorophenyl)-2-(2-fluorophenyl)-4,5-dihydroimidazol-4-ol
CID 141291648

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one?
The IUPAC name of 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one (CID 136896249) is 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one.
What is the SMILES notation for 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one?
The canonical SMILES for 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one is CC(C)C1N=C(c2cc(Cl)ccc2O)N(c2cccc(Cl)c2)C1=O.
What is the InChIKey of 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one?
The InChIKey is GXRLRVGVBVHIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N2O2/c1-10(2)16-18(24)22(13-5-3-4-11(19)8-13)17(21-16)14-9-12(20)6-7-15(14)23/h3-10,16,23H,1-2H3.
What are the key properties of 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one?
2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one has a molecular weight of 363.24 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-hydroxyphenyl)-1-(3-chlorophenyl)-4-propan-2-yl-4H-imidazol-5-one is sourced from PubChem (CID 136896249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).