3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine

C16H17NO3S2 — CID 2859306

IUPAC3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine
SMILESCOc1ccc(C2SCCN2S(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C16H17NO3S2/c1-20-14-9-7-13(8-10-14)16-17(11-12-21-16)22(18,19)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3
InChIKeyRMJKDUJAELMCNT-UHFFFAOYSA-N
MW335.45 g/mol
LogP3.13
Rot. Bonds4

About 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine

3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine (PubChem CID 2859306) has the molecular formula C16H17NO3S2 and a molecular weight of 335.45 g/mol. Its IUPAC name is 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine.

Molecular Properties

Compound Name3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine
PubChem CID2859306
Molecular FormulaC16H17NO3S2
Molecular Weight335.45 g/mol
Exact Mass335.06
IUPAC Name3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine
SMILESCOc1ccc(C2SCCN2S(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C16H17NO3S2/c1-20-14-9-7-13(8-10-14)16-17(11-12-21-16)22(18,19)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3
InChIKeyRMJKDUJAELMCNT-UHFFFAOYSA-N
XLogP3.13
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine 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

4-[2-[(4-Methoxyphenyl)methylamino]ethyl]benzenesulfonamide
CID 4718971
2-(3,4-Dimethoxy-phenyl)-3-(4-fluoro-benzenesulfonyl)-thiazolidine
CID 656153
2-(2-Methoxy-phenyl)-3-(3-trifluoromethyl-benzenesulfonyl)-thiazolidine
CID 646735
3-Benzenesulfonyl-2-(3,4-dimethoxy-phenyl)-thiazolidine
CID 652980
4-methoxy-N-{[(4-methylphenyl)sulfonyl]methyl}benzenecarbothioamide
CID 845853
2-(4-Methoxyphenyl)-1,3-bis[(4-methylphenyl)sulfonyl]imidazolidine
CID 1239779
(4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione
CID 2146185
2-(2,5-Dimethoxyphenyl)-3-{[3-(trifluoromethyl)phenyl]sulfonyl}-1,3-thiazolidine
CID 3236242
2-(4-Methoxyphenyl)-1-[(4-methylphenyl)sulfonyl]-3-(phenylsulfonyl)imidazolidine
CID 3368587
3-(Benzenesulfonyl)-2-(2-methoxyphenyl)-1,3-thiazolidine
CID 4174260
1-(Benzylsulfonyl)-4-(4-methoxybenzyl)piperazine
CID 17368168
1,1-Dioxo-3-(4-phenoxy-benzyl)-1lambda6-thiazolidin-2-one
CID 44430058

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine?
The IUPAC name of 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine (CID 2859306) is 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine.
What is the SMILES notation for 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine?
The canonical SMILES for 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine is COc1ccc(C2SCCN2S(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine?
The InChIKey is RMJKDUJAELMCNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3S2/c1-20-14-9-7-13(8-10-14)16-17(11-12-21-16)22(18,19)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3.
What are the key properties of 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine?
3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine has a molecular weight of 335.45 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-thiazolidine is sourced from PubChem (CID 2859306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).