1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine

C19H24N2O2S — CID 6465958

IUPAC1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine
SMILESCc1ccc(S(=O)(=O)N2CCN(c3ccccc3C)CC2)c(C)c1
InChIInChI=1S/C19H24N2O2S/c1-15-8-9-19(17(3)14-15)24(22,23)21-12-10-20(11-13-21)18-7-5-4-6-16(18)2/h4-9,14H,10-13H2,1-3H3
InChIKeyPIDIRRCGJLMJPR-UHFFFAOYSA-N
MW344.48 g/mol
LogP3.12
Rot. Bonds3

About 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine

1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine (PubChem CID 6465958) has the molecular formula C19H24N2O2S and a molecular weight of 344.48 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine
PubChem CID6465958
Molecular FormulaC19H24N2O2S
Molecular Weight344.48 g/mol
Exact Mass344.16
IUPAC Name1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine
SMILESCc1ccc(S(=O)(=O)N2CCN(c3ccccc3C)CC2)c(C)c1
InChIInChI=1S/C19H24N2O2S/c1-15-8-9-19(17(3)14-15)24(22,23)21-12-10-20(11-13-21)18-7-5-4-6-16(18)2/h4-9,14H,10-13H2,1-3H3
InChIKeyPIDIRRCGJLMJPR-UHFFFAOYSA-N
XLogP3.12
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.48
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dimethylphenyl)-4-(2,4-dimethylphenyl)sulfonylpiperazine
CID 2114453
1-(4-methoxy-2-methylphenyl)sulfonyl-4-(2-methylphenyl)piperazine
CID 113075257
1-(2-methylphenyl)-4-(4-methylphenyl)sulfonylpiperazine
CID 674120
1-(4-bromo-2,5-dimethylphenyl)sulfonyl-4-(2,4-dimethylphenyl)piperazine
CID 2137807
1-(2,4-dimethylphenyl)sulfonyl-4-ethylsulfonylpiperazine
CID 78788595
1-(3-chloro-4-methylphenyl)-4-(2,4-dimethylphenyl)sulfonylpiperazine
CID 2137811
1-(2-methoxy-4-methylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
CID 1143543
1-(3,4-dichlorophenyl)-4-(2,4-dimethylphenyl)sulfonylpiperazine
CID 991799
1-(2,4-dimethylphenyl)sulfonyl-2,3-dihydroquinolin-4-one
CID 110604092
1-(2-ethylphenyl)-4-(4-fluoro-2-methylphenyl)sulfonylpiperazine
CID 113075851
4-(2,4-dimethylphenyl)sulfonyl-1,4-diazepane-1-sulfonamide
CID 56806267
1-(2-tert-butylphenyl)-4-(2-methylphenyl)sulfonylpiperazine
CID 113076530

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine?
The IUPAC name of 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine (CID 6465958) is 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine.
What is the SMILES notation for 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine?
The canonical SMILES for 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine is Cc1ccc(S(=O)(=O)N2CCN(c3ccccc3C)CC2)c(C)c1.
What is the InChIKey of 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine?
The InChIKey is PIDIRRCGJLMJPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2S/c1-15-8-9-19(17(3)14-15)24(22,23)21-12-10-20(11-13-21)18-7-5-4-6-16(18)2/h4-9,14H,10-13H2,1-3H3.
What are the key properties of 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine?
1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine has a molecular weight of 344.48 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)sulfonyl-4-(2-methylphenyl)piperazine is sourced from PubChem (CID 6465958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).