2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine

C20H19NO3S2 — CID 3383864

IUPAC2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine
SMILESCOc1ccccc1C1SCCN1S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C20H19NO3S2/c1-24-19-9-5-4-8-18(19)20-21(12-13-25-20)26(22,23)17-11-10-15-6-2-3-7-16(15)14-17/h2-11,14,20H,12-13H2,1H3
InChIKeyCZJXIQGPDWVRFL-UHFFFAOYSA-N
MW385.51 g/mol
LogP4.28
Rot. Bonds4

About 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine

2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine (PubChem CID 3383864) has the molecular formula C20H19NO3S2 and a molecular weight of 385.51 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine
PubChem CID3383864
Molecular FormulaC20H19NO3S2
Molecular Weight385.51 g/mol
Exact Mass385.08
IUPAC Name2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine
SMILESCOc1ccccc1C1SCCN1S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C20H19NO3S2/c1-24-19-9-5-4-8-18(19)20-21(12-13-25-20)26(22,23)17-11-10-15-6-2-3-7-16(15)14-17/h2-11,14,20H,12-13H2,1H3
InChIKeyCZJXIQGPDWVRFL-UHFFFAOYSA-N
XLogP4.28
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.51
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-fluorophenyl)sulfonyl-2-(2-methoxyphenyl)-1,3-thiazolidine
CID 3144179
(2S)-2-(3,4-dimethoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine
CID 1111413
(2S)-2-(2-methoxyphenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 1362906
3-(4-iodophenyl)sulfonyl-2-(2-methoxyphenyl)-1,3-thiazolidine
CID 3562992
3-(4-ethylphenyl)sulfonyl-2-(2-methoxyphenyl)-1,3-thiazolidine
CID 3302390
(2R)-2-(2,5-dimethoxyphenyl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine
CID 1143496
2-(2-methoxyphenyl)-3-naphthalen-1-ylsulfonyl-1,3-thiazolidine
CID 3930922
3-naphthalen-2-ylsulfonyl-2-phenyl-1,3-thiazolidine
CID 2848104
(2S)-2-(2,5-dimethoxyphenyl)-3-(3-methylphenyl)sulfonyl-1,3-thiazolidine
CID 1143477
2-(2,5-dimethoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine
CID 3144172
(2S)-3-(benzenesulfonyl)-2-(5-bromo-2-methoxyphenyl)-1,3-thiazolidine
CID 7013332
(2S)-2-(5-bromo-2-methoxyphenyl)-3-(4-bromophenyl)sulfonyl-1,3-thiazolidine
CID 40837331

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine?
The IUPAC name of 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine (CID 3383864) is 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine.
What is the SMILES notation for 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine?
The canonical SMILES for 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine is COc1ccccc1C1SCCN1S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine?
The InChIKey is CZJXIQGPDWVRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO3S2/c1-24-19-9-5-4-8-18(19)20-21(12-13-25-20)26(22,23)17-11-10-15-6-2-3-7-16(15)14-17/h2-11,14,20H,12-13H2,1H3.
What are the key properties of 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine?
2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine has a molecular weight of 385.51 g/mol, XLogP of 4.28, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine is sourced from PubChem (CID 3383864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).