1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine

C24H26N2OS — CID 51672151

IUPAC1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine
SMILESCOc1ccc([C@H](Sc2ccccc2)N2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C24H26N2OS/c1-27-22-14-12-20(13-15-22)24(28-23-10-6-3-7-11-23)26-18-16-25(17-19-26)21-8-4-2-5-9-21/h2-15,24H,16-19H2,1H3/t24-/m0/s1
InChIKeyFCVOFFXYYIWZOA-DEOSSOPVSA-N
MW390.55 g/mol
LogP5.31
Rot. Bonds6

About 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine

1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine (PubChem CID 51672151) has the molecular formula C24H26N2OS and a molecular weight of 390.55 g/mol. Its IUPAC name is 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine.

Molecular Properties

Compound Name1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine
PubChem CID51672151
Molecular FormulaC24H26N2OS
Molecular Weight390.55 g/mol
Exact Mass390.18
IUPAC Name1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine
SMILESCOc1ccc([C@H](Sc2ccccc2)N2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C24H26N2OS/c1-27-22-14-12-20(13-15-22)24(28-23-10-6-3-7-11-23)26-18-16-25(17-19-26)21-8-4-2-5-9-21/h2-15,24H,16-19H2,1H3/t24-/m0/s1
InChIKeyFCVOFFXYYIWZOA-DEOSSOPVSA-N
XLogP5.31
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.55
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine 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

(2S)-2-(4-methoxyphenyl)-2-(4-phenylpiperazin-1-yl)ethanamine
CID 9161175
(2S)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-phenylsulfanylpropan-1-one
CID 7759872
2-[[4-(4-methoxyphenyl)piperazin-1-yl]-phenylmethyl]phenol
CID 174990296
1-[(R)-(1-benzyltetrazol-5-yl)-(4-methoxyphenyl)methyl]-4-phenylpiperazine
CID 1446248
1-[(4-methoxyphenyl)-(1-propan-2-yltetrazol-5-yl)methyl]-4-phenylpiperazine;hydrochloride
CID 171668322
2-(4-methoxyphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethanamine
CID 16642461
1-[(2S)-2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine
CID 92967649
2-hydroxy-1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-phenylethanone
CID 110879916
1-[[1-(2-methoxyethyl)tetrazol-5-yl]-(4-methoxyphenyl)methyl]-4-phenylpiperazine
CID 3209327
1-[(R)-(1-benzyltetrazol-5-yl)-(4-methoxyphenyl)methyl]-4-(4-methoxyphenyl)piperazine
CID 1446260
1-[[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]-phenylmethyl]-4-phenylpiperazine
CID 3209960
1-[(R)-(4-methoxyphenyl)-[1-(2-phenylethyl)tetrazol-5-yl]methyl]-4-phenylpiperazine
CID 1449129

Frequently Asked Questions

What is the IUPAC name of 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine?
The IUPAC name of 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine (CID 51672151) is 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine.
What is the SMILES notation for 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine?
The canonical SMILES for 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine is COc1ccc([C@H](Sc2ccccc2)N2CCN(c3ccccc3)CC2)cc1.
What is the InChIKey of 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine?
The InChIKey is FCVOFFXYYIWZOA-DEOSSOPVSA-N. The full InChI is InChI=1S/C24H26N2OS/c1-27-22-14-12-20(13-15-22)24(28-23-10-6-3-7-11-23)26-18-16-25(17-19-26)21-8-4-2-5-9-21/h2-15,24H,16-19H2,1H3/t24-/m0/s1.
What are the key properties of 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine?
1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine has a molecular weight of 390.55 g/mol, XLogP of 5.31, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(S)-(4-methoxyphenyl)-phenylsulfanylmethyl]-4-phenylpiperazine is sourced from PubChem (CID 51672151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).