1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine

C19H24N2O7S2 — CID 19684107

IUPAC1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine
SMILESCOc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(OC)cc3OC)CC2)cc1
InChIInChI=1S/C19H24N2O7S2/c1-26-15-4-7-17(8-5-15)29(22,23)20-10-12-21(13-11-20)30(24,25)19-9-6-16(27-2)14-18(19)28-3/h4-9,14H,10-13H2,1-3H3
InChIKeyACEJAJCAQGFMID-UHFFFAOYSA-N
MW456.54 g/mol
LogP1.41
Rot. Bonds7

About 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine

1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine (PubChem CID 19684107) has the molecular formula C19H24N2O7S2 and a molecular weight of 456.54 g/mol. Its IUPAC name is 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine.

Molecular Properties

Compound Name1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine
PubChem CID19684107
Molecular FormulaC19H24N2O7S2
Molecular Weight456.54 g/mol
Exact Mass456.10
IUPAC Name1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine
SMILESCOc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(OC)cc3OC)CC2)cc1
InChIInChI=1S/C19H24N2O7S2/c1-26-15-4-7-17(8-5-15)29(22,23)20-10-12-21(13-11-20)30(24,25)19-9-6-16(27-2)14-18(19)28-3/h4-9,14H,10-13H2,1-3H3
InChIKeyACEJAJCAQGFMID-UHFFFAOYSA-N
XLogP1.41
TPSA102.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.54
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-cyclopropyl-4-(2,4-dimethoxyphenyl)sulfonylpiperazine
CID 110708580
4-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]sulfonylaniline
CID 2052121
1-butan-2-yl-4-(2,4-dimethoxyphenyl)sulfonylpiperazine
CID 113072995
1-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2,2-dimethylpropan-1-one
CID 110817974
4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine
CID 113073742
[1-(2,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]methanamine
CID 43605335
ethyl 4-(2,4-dimethoxyphenyl)sulfonylpiperazine-1-carboxylate
CID 91669968
2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazine-1-carbonyl]benzoate
CID 2051902
4-(2,4-dimethoxyphenyl)sulfonyl-2,6-dimethylmorpholine
CID 19682685
1-(2,4-dimethoxyphenyl)-4-(3,4-dimethoxyphenyl)sulfonylpiperazine
CID 5000474
3-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]benzoic acid
CID 2052084
1-(2,4-dimethoxyphenyl)sulfonyl-N,N-dimethylpiperidine-4-carboxamide
CID 110350848

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine?
The IUPAC name of 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine (CID 19684107) is 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine.
What is the SMILES notation for 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine?
The canonical SMILES for 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine is COc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(OC)cc3OC)CC2)cc1.
What is the InChIKey of 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine?
The InChIKey is ACEJAJCAQGFMID-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O7S2/c1-26-15-4-7-17(8-5-15)29(22,23)20-10-12-21(13-11-20)30(24,25)19-9-6-16(27-2)14-18(19)28-3/h4-9,14H,10-13H2,1-3H3.
What are the key properties of 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine?
1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine has a molecular weight of 456.54 g/mol, XLogP of 1.41, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine is sourced from PubChem (CID 19684107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).