4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide

C120H145F6N5O34S5 — CID 157493997

About 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide

4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide (PubChem CID 157493997) has the molecular formula C120H145F6N5O34S5 and a molecular weight of 2475.80 g/mol. Its IUPAC name is 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide.

Molecular Properties

• Compound Name: 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide
• PubChem CID: 157493997
• Molecular Formula: C120H145F6N5O34S5
• Molecular Weight: 2475.80 g/mol
• Exact Mass: 2473.83
• IUPAC Name: 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide
• SMILES: CC(=O)c1cccc(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)c1.CC(C)CCCc1cccc(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)c1.CCC(=O)c1cccc(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)c1.COc1cc(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)cc(OC)c1.O=C(NO)C1(S(=O)(=O)c2ccc(OCCCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)CCOCC1
• InChI: InChI=1S/C27H37NO6S.C24H29NO7S.C23H23F6NO6S.C23H29NO8S.C23H27NO7S/c1-21(2)6-3-7-22-8-4-9-23(20-22)10-5-17-34-24-11-13-25(14-12-24)35(31,32)27(26(29)28-30)15-18-33-19-16-27;1-2-22(26)19-7-3-5-18(17-19)6-4-14-32-20-8-10-21(11-9-20)33(29,30)24(23(27)25-28)12-15-31-16-13-24;24-22(25,26)16-12-15(13-17(14-16)23(27,28)29)2-1-9-36-18-3-5-19(6-4-18)37(33,34)21(20(31)30-32)7-10-35-11-8-21;1-29-19-14-17(15-20(16-19)30-2)4-3-11-32-18-5-7-21(8-6-18)33(27,28)23(22(25)24-26)9-12-31-13-10-23;1-17(25)19-6-2-4-18(16-19)5-3-13-31-20-7-9-21(10-8-20)32(28,29)23(22(26)24-27)11-14-30-15-12-23/h4,8-9,11-14,20-21,30H,3,5-7,10,15-19H2,1-2H3,(H,28,29);3,5,7-11,17,28H,2,4,6,12-16H2,1H3,(H,25,27);3-6,12-14,32H,1-2,7-11H2,(H,30,31);5-8,14-16,26H,3-4,9-13H2,1-2H3,(H,24,25);2,4,6-10,16,27H,3,5,11-15H2,1H3,(H,24,26)
• InChIKey: BXPKVYGEYDHGJX-UHFFFAOYSA-N
• XLogP: 17.46
• TPSA: 562.25 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 34
• Rotatable Bonds: 49
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2475.80
LogP ≤ 5	17.46
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide?

The IUPAC name of 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide (CID 157493997) is 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide.

What is the SMILES notation for 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide?

The canonical SMILES for 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide is CC(=O)c1cccc(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)c1.CC(C)CCCc1cccc(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)c1.CCC(=O)c1cccc(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)c1.COc1cc(CCCOc2ccc(S(=O)(=O)C3(C(=O)NO)CCOCC3)cc2)cc(OC)c1.O=C(NO)C1(S(=O)(=O)c2ccc(OCCCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)CCOCC1.

What is the InChIKey of 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide?

The InChIKey is BXPKVYGEYDHGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H37NO6S.C24H29NO7S.C23H23F6NO6S.C23H29NO8S.C23H27NO7S/c1-21(2)6-3-7-22-8-4-9-23(20-22)10-5-17-34-24-11-13-25(14-12-24)35(31,32)27(26(29)28-30)15-18-33-19-16-27;1-2-22(26)19-7-3-5-18(17-19)6-4-14-32-20-8-10-21(11-9-20)33(29,30)24(23(27)25-28)12-15-31-16-13-24;24-22(25,26)16-12-15(13-17(14-16)23(27,28)29)2-1-9-36-18-3-5-19(6-4-18)37(33,34)21(20(31)30-32)7-10-35-11-8-21;1-29-19-14-17(15-20(16-19)30-2)4-3-11-32-18-5-7-21(8-6-18)33(27,28)23(22(25)24-26)9-12-31-13-10-23;1-17(25)19-6-2-4-18(16-19)5-3-13-31-20-7-9-21(10-8-20)32(28,29)23(22(26)24-27)11-14-30-15-12-23/h4,8-9,11-14,20-21,30H,3,5-7,10,15-19H2,1-2H3,(H,28,29);3,5,7-11,17,28H,2,4,6,12-16H2,1H3,(H,25,27);3-6,12-14,32H,1-2,7-11H2,(H,30,31);5-8,14-16,26H,3-4,9-13H2,1-2H3,(H,24,25);2,4,6-10,16,27H,3,5,11-15H2,1H3,(H,24,26).

What are the key properties of 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide?

4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide has a molecular weight of 2475.80 g/mol, XLogP of 17.46, 49 rotatable bonds, 10 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-[3-(3-acetylphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-[3,5-bis(trifluoromethyl)phenyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;4-[4-[3-(3,5-dimethoxyphenyl)propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide;N-hydroxy-4-[4-[3-[3-(4-methylpentyl)phenyl]propoxy]phenyl]sulfonyloxane-4-carboxamide;N-hydroxy-4-[4-[3-(3-propanoylphenyl)propoxy]phenyl]sulfonyloxane-4-carboxamide is sourced from PubChem (CID 157493997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).