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

C19H24N2O4S — CID 1143543

IUPAC1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
SMILESCOc1ccccc1N1CCN(S(=O)(=O)c2ccc(C)cc2OC)CC1
InChIInChI=1S/C19H24N2O4S/c1-15-8-9-19(18(14-15)25-3)26(22,23)21-12-10-20(11-13-21)16-6-4-5-7-17(16)24-2/h4-9,14H,10-13H2,1-3H3
InChIKeyXLBILLVCAMIUAM-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.52
Rot. Bonds5

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

1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine (PubChem CID 1143543) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine.

Molecular Properties

Compound Name1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
PubChem CID1143543
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
SMILESCOc1ccccc1N1CCN(S(=O)(=O)c2ccc(C)cc2OC)CC1
InChIInChI=1S/C19H24N2O4S/c1-15-8-9-19(18(14-15)25-3)26(22,23)21-12-10-20(11-13-21)16-6-4-5-7-17(16)24-2/h4-9,14H,10-13H2,1-3H3
InChIKeyXLBILLVCAMIUAM-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-fluoro-2-methoxyphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 1085530
1-(2,5-dimethoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 91669754
1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 113077346
1-(2,4-dichloro-5-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 23932557
1-(2,5-dimethylphenyl)-4-(2-methoxy-4,5-dimethylphenyl)sulfonylpiperazine
CID 113075483
1-(2,3-dimethylphenyl)-4-(2-methoxy-5-methylphenyl)sulfonylpiperazine
CID 1260959
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-(2-methoxy-5-methylphenyl)sulfonyl-4-phenylpiperazine
CID 775526
1-(3,5-dichlorophenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 2741701
1-(2,6-dichlorophenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 4089180

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine?
The IUPAC name of 1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine (CID 1143543) is 1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine.
What is the SMILES notation for 1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine?
The canonical SMILES for 1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine is COc1ccccc1N1CCN(S(=O)(=O)c2ccc(C)cc2OC)CC1.
What is the InChIKey of 1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine?
The InChIKey is XLBILLVCAMIUAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-15-8-9-19(18(14-15)25-3)26(22,23)21-12-10-20(11-13-21)16-6-4-5-7-17(16)24-2/h4-9,14H,10-13H2,1-3H3.
What are the key properties of 1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine?
1-(2-methoxy-4-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-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine is sourced from PubChem (CID 1143543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).