4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide

C99H117FN12O30S4 — CID 158537007

IUPAC4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide
SMILESCOc1ccc(N2CCN(CCCOc3ccc(S(=O)(=O)C4(C(=O)NO)CCOCC4)cc3)C2=O)cc1.Cc1ccc(N2CCN(CCCOc3ccc(S(=O)(=O)C4(C(=O)NO)CCOCC4)cc3)C2=O)cc1.O=C1N(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)CCN1c1ccc(F)cc1.O=C1N/C(=C\c2ccccc2)C(=O)N1CCCOc1ccc(S(=O)(=O)C2(C(=O)NO)CCOCC2)cc1
InChIInChI=1S/C25H31N3O8S.C25H27N3O8S.C25H31N3O7S.C24H28FN3O7S/c1-34-20-5-3-19(4-6-20)28-15-14-27(24(28)30)13-2-16-36-21-7-9-22(10-8-21)37(32,33)25(23(29)26-31)11-17-35-18-12-25;29-22-21(17-18-5-2-1-3-6-18)26-24(31)28(22)13-4-14-36-19-7-9-20(10-8-19)37(33,34)25(23(30)27-32)11-15-35-16-12-25;1-19-3-5-20(6-4-19)28-15-14-27(24(28)30)13-2-16-35-21-7-9-22(10-8-21)36(32,33)25(23(29)26-31)11-17-34-18-12-25;25-18-2-4-19(5-3-18)28-14-13-27(23(28)30)12-1-15-35-20-6-8-21(9-7-20)36(32,33)24(22(29)26-31)10-16-34-17-11-24/h3-10,31H,2,11-18H2,1H3,(H,26,29);1-3,5-10,17,32H,4,11-16H2,(H,26,31)(H,27,30);3-10,31H,2,11-18H2,1H3,(H,26,29);2-9,31H,1,10-17H2,(H,26,29)/b;21-17-;;
InChIKeyHOBGORBGRNNAAR-MVVPKDKESA-N
MW2102.34 g/mol
LogP9.01
Rot. Bonds37

About 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide

4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide (PubChem CID 158537007) has the molecular formula C99H117FN12O30S4 and a molecular weight of 2102.34 g/mol. Its IUPAC name is 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide.

Molecular Properties

Compound Name4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide
PubChem CID158537007
Molecular FormulaC99H117FN12O30S4
Molecular Weight2102.34 g/mol
Exact Mass2100.69
IUPAC Name4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide
SMILESCOc1ccc(N2CCN(CCCOc3ccc(S(=O)(=O)C4(C(=O)NO)CCOCC4)cc3)C2=O)cc1.Cc1ccc(N2CCN(CCCOc3ccc(S(=O)(=O)C4(C(=O)NO)CCOCC4)cc3)C2=O)cc1.O=C1N(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)CCN1c1ccc(F)cc1.O=C1N/C(=C\c2ccccc2)C(=O)N1CCCOc1ccc(S(=O)(=O)C2(C(=O)NO)CCOCC2)cc1
InChIInChI=1S/C25H31N3O8S.C25H27N3O8S.C25H31N3O7S.C24H28FN3O7S/c1-34-20-5-3-19(4-6-20)28-15-14-27(24(28)30)13-2-16-36-21-7-9-22(10-8-21)37(32,33)25(23(29)26-31)11-17-35-18-12-25;29-22-21(17-18-5-2-1-3-6-18)26-24(31)28(22)13-4-14-36-19-7-9-20(10-8-19)37(33,34)25(23(30)27-32)11-15-35-16-12-25;1-19-3-5-20(6-4-19)28-15-14-27(24(28)30)13-2-16-35-21-7-9-22(10-8-21)36(32,33)25(23(29)26-31)11-17-34-18-12-25;25-18-2-4-19(5-3-18)28-14-13-27(23(28)30)12-1-15-35-20-6-8-21(9-7-20)36(32,33)24(22(29)26-31)10-16-34-17-11-24/h3-10,31H,2,11-18H2,1H3,(H,26,29);1-3,5-10,17,32H,4,11-16H2,(H,26,31)(H,27,30);3-10,31H,2,11-18H2,1H3,(H,26,29);2-9,31H,1,10-17H2,(H,26,29)/b;21-17-;;
InChIKeyHOBGORBGRNNAAR-MVVPKDKESA-N
XLogP9.01
TPSA537.01 Ų
H-Bond Donors9
H-Bond Acceptors30
Rotatable Bonds37
Heavy Atoms146
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002102.34
LogP ≤ 59.01
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide with MolForge

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Related Compounds

4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide
CID 20620482
4-[4-[3-(2,5-dioxo-3-phenylimidazolidin-1-yl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide
CID 20620402
N-hydroxy-4-[4-[(4R)-4-methyl-5-[2-oxo-3-[4-(trifluoromethoxy)phenyl]imidazolidin-1-yl]pentoxy]phenyl]sulfonyloxane-4-carboxamide
CID 142895744
N-hydroxy-4-[4-[3-(4-methoxyphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide
CID 20620571
4-[4-[3-(2,5-dioxo-4-phenylimidazolidin-1-yl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide
CID 20620403
4-[4-[3-(3,4-dihydro-2H-quinolin-1-yl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide
CID 20620474
N-hydroxy-4-[4-[(E)-2-methyl-3-phenylprop-2-enoxy]phenyl]sulfonyloxane-4-carboxamide
CID 20620387
N-hydroxy-4-[4-[4-(4-methoxyphenyl)-4-oxobutoxy]phenyl]sulfonyloxane-4-carboxamide
CID 10184126
4-[4-[4-(3,4-dihydro-2H-quinolin-1-yl)butoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide
CID 20620686
N-hydroxy-4-[4-[4-(4-methoxyphenyl)butyl]phenyl]sulfonyloxane-4-carboxamide
CID 20620689
N-hydroxy-4-[4-[3-(methylsulfamoyl)propoxy]phenyl]sulfonyloxane-4-carboxamide
CID 20620677
4-[4-[5-(3,4-dihydro-2H-quinolin-1-yl)pentoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;2,2,2-trifluoroacetic acid
CID 162305783

Frequently Asked Questions

What is the IUPAC name of 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide?
The IUPAC name of 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide (CID 158537007) is 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide.
What is the SMILES notation for 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide?
The canonical SMILES for 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide is COc1ccc(N2CCN(CCCOc3ccc(S(=O)(=O)C4(C(=O)NO)CCOCC4)cc3)C2=O)cc1.Cc1ccc(N2CCN(CCCOc3ccc(S(=O)(=O)C4(C(=O)NO)CCOCC4)cc3)C2=O)cc1.O=C1N(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)CCN1c1ccc(F)cc1.O=C1N/C(=C\c2ccccc2)C(=O)N1CCCOc1ccc(S(=O)(=O)C2(C(=O)NO)CCOCC2)cc1.
What is the InChIKey of 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide?
The InChIKey is HOBGORBGRNNAAR-MVVPKDKESA-N. The full InChI is InChI=1S/C25H31N3O8S.C25H27N3O8S.C25H31N3O7S.C24H28FN3O7S/c1-34-20-5-3-19(4-6-20)28-15-14-27(24(28)30)13-2-16-36-21-7-9-22(10-8-21)37(32,33)25(23(29)26-31)11-17-35-18-12-25;29-22-21(17-18-5-2-1-3-6-18)26-24(31)28(22)13-4-14-36-19-7-9-20(10-8-19)37(33,34)25(23(30)27-32)11-15-35-16-12-25;1-19-3-5-20(6-4-19)28-15-14-27(24(28)30)13-2-16-35-21-7-9-22(10-8-21)36(32,33)25(23(29)26-31)11-17-34-18-12-25;25-18-2-4-19(5-3-18)28-14-13-27(23(28)30)12-1-15-35-20-6-8-21(9-7-20)36(32,33)24(22(29)26-31)10-16-34-17-11-24/h3-10,31H,2,11-18H2,1H3,(H,26,29);1-3,5-10,17,32H,4,11-16H2,(H,26,31)(H,27,30);3-10,31H,2,11-18H2,1H3,(H,26,29);2-9,31H,1,10-17H2,(H,26,29)/b;21-17-;;.
What are the key properties of 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide?
4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide has a molecular weight of 2102.34 g/mol, XLogP of 9.01, 37 rotatable bonds, 9 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[3-[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3-(4-fluorophenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methoxyphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylphenyl)-2-oxoimidazolidin-1-yl]propoxy]phenyl]sulfonyloxane-4-carboxamide is sourced from PubChem (CID 158537007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).