1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine

C19H23ClN2O5S — CID 3496187

IUPAC1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine
SMILESCOc1ccc(OC)c(S(=O)(=O)N2CCN(c3cc(Cl)ccc3OC)CC2)c1
InChIInChI=1S/C19H23ClN2O5S/c1-25-15-5-7-18(27-3)19(13-15)28(23,24)22-10-8-21(9-11-22)16-12-14(20)4-6-17(16)26-2/h4-7,12-13H,8-11H2,1-3H3
InChIKeyOMFXFFAHMPWCHI-UHFFFAOYSA-N
MW426.92 g/mol
LogP2.88
Rot. Bonds6

About 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine

1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine (PubChem CID 3496187) has the molecular formula C19H23ClN2O5S and a molecular weight of 426.92 g/mol. Its IUPAC name is 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine.

Molecular Properties

Compound Name1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine
PubChem CID3496187
Molecular FormulaC19H23ClN2O5S
Molecular Weight426.92 g/mol
Exact Mass426.10
IUPAC Name1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine
SMILESCOc1ccc(OC)c(S(=O)(=O)N2CCN(c3cc(Cl)ccc3OC)CC2)c1
InChIInChI=1S/C19H23ClN2O5S/c1-25-15-5-7-18(27-3)19(13-15)28(23,24)22-10-8-21(9-11-22)16-12-14(20)4-6-17(16)26-2/h4-7,12-13H,8-11H2,1-3H3
InChIKeyOMFXFFAHMPWCHI-UHFFFAOYSA-N
XLogP2.88
TPSA68.31 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.92
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-chloro-5-methoxyphenyl)sulfonyl-4-(2,5-dichlorophenyl)piperazine
CID 1178550
1-(4-chloro-2-methylphenyl)-4-(2-methoxy-5-methylphenyl)sulfonylpiperazine
CID 113076822
1-(2,5-dimethoxyphenyl)sulfonyl-4-(3-methoxyphenyl)piperazine
CID 3853607
1-(4-chloro-2,5-dimethylphenyl)sulfonyl-4-(2,5-dimethoxyphenyl)sulfonylpiperazine
CID 19684880
2-[4-(5-chloro-2-methoxyphenyl)sulfonylpiperazin-1-yl]benzonitrile
CID 113080892
2-[3-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-4-methoxyphenyl]sulfonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline
CID 46088792
1-(5-chloro-2-methoxyphenyl)sulfonylpiperidine
CID 757936
1-(benzenesulfonyl)-4-(2,5-dimethoxyphenyl)piperazine
CID 113077853
1-(5-chlorothiophen-2-yl)sulfonyl-4-(2,5-dimethoxyphenyl)sulfonylpiperazine
CID 19684867
1-(2,5-dimethoxyphenyl)sulfonyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)piperazine
CID 90507124
4-(5-chloro-2-methoxyphenyl)sulfonylthiomorpholine
CID 27241340
4-(2,5-dimethoxyphenyl)sulfonyl-1,4-thiazinane 1,1-dioxide
CID 110721462

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine?
The IUPAC name of 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine (CID 3496187) is 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine.
What is the SMILES notation for 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine?
The canonical SMILES for 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine is COc1ccc(OC)c(S(=O)(=O)N2CCN(c3cc(Cl)ccc3OC)CC2)c1.
What is the InChIKey of 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine?
The InChIKey is OMFXFFAHMPWCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O5S/c1-25-15-5-7-18(27-3)19(13-15)28(23,24)22-10-8-21(9-11-22)16-12-14(20)4-6-17(16)26-2/h4-7,12-13H,8-11H2,1-3H3.
What are the key properties of 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine?
1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine has a molecular weight of 426.92 g/mol, XLogP of 2.88, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-methoxyphenyl)-4-(2,5-dimethoxyphenyl)sulfonylpiperazine is sourced from PubChem (CID 3496187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).