1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine

C19H24N2O4S — CID 113077346

IUPAC1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
SMILESCOc1ccc(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)c(C)c1
InChIInChI=1S/C19H24N2O4S/c1-15-14-16(24-2)8-9-19(15)26(22,23)21-12-10-20(11-13-21)17-6-4-5-7-18(17)25-3/h4-9,14H,10-13H2,1-3H3
InChIKeyVWJPLQMPMXLOTR-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.52
Rot. Bonds5

About 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine

1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine (PubChem CID 113077346) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine.

Molecular Properties

Compound Name1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
PubChem CID113077346
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
SMILESCOc1ccc(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)c(C)c1
InChIInChI=1S/C19H24N2O4S/c1-15-14-16(24-2)8-9-19(15)26(22,23)21-12-10-20(11-13-21)17-6-4-5-7-18(17)25-3/h4-9,14H,10-13H2,1-3H3
InChIKeyVWJPLQMPMXLOTR-UHFFFAOYSA-N
XLogP2.52
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methylphenyl)piperazine
CID 113075257
1-(2,4-dimethoxyphenyl)-4-(2-methylphenyl)sulfonylpiperazine
CID 113077949
1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-propan-2-ylphenyl)piperazine
CID 113076150
1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 1143543
1-(2,5-dimethoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 91669754
1-(2,4-dichloro-5-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 23932557
1-(4-fluoro-2-methoxyphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 1085530
1-(benzenesulfonyl)-4-(2,5-dimethoxyphenyl)piperazine
CID 113077853
4-methoxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylbenzoic acid
CID 2456144
1-(3,4-dimethoxyphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 1201987
1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine
CID 6465958
1-(3,5-dichlorophenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 2741701

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine?
The IUPAC name of 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine (CID 113077346) is 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine.
What is the SMILES notation for 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine?
The canonical SMILES for 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine is COc1ccc(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)c(C)c1.
What is the InChIKey of 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine?
The InChIKey is VWJPLQMPMXLOTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-15-14-16(24-2)8-9-19(15)26(22,23)21-12-10-20(11-13-21)17-6-4-5-7-18(17)25-3/h4-9,14H,10-13H2,1-3H3.
What are the key properties of 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine?
1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine has a molecular weight of 376.48 g/mol, XLogP of 2.52, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine is sourced from PubChem (CID 113077346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).