(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine

C14H15NO4S2 — CID 1084382

IUPAC(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine
SMILESCOc1ccc(S(=O)(=O)N2CCS[C@H]2c2ccco2)cc1
InChIInChI=1S/C14H15NO4S2/c1-18-11-4-6-12(7-5-11)21(16,17)15-8-10-20-14(15)13-3-2-9-19-13/h2-7,9,14H,8,10H2,1H3/t14-/m0/s1
InChIKeyGPOKOHIDPJJOOC-AWEZNQCLSA-N
MW325.41 g/mol
LogP2.72
Rot. Bonds4

About (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine

(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine (PubChem CID 1084382) has the molecular formula C14H15NO4S2 and a molecular weight of 325.41 g/mol. Its IUPAC name is (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine.

Molecular Properties

Compound Name(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine
PubChem CID1084382
Molecular FormulaC14H15NO4S2
Molecular Weight325.41 g/mol
Exact Mass325.04
IUPAC Name(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine
SMILESCOc1ccc(S(=O)(=O)N2CCS[C@H]2c2ccco2)cc1
InChIInChI=1S/C14H15NO4S2/c1-18-11-4-6-12(7-5-11)21(16,17)15-8-10-20-14(15)13-3-2-9-19-13/h2-7,9,14H,8,10H2,1H3/t14-/m0/s1
InChIKeyGPOKOHIDPJJOOC-AWEZNQCLSA-N
XLogP2.72
TPSA59.75 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine
CID 2858670
(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine
CID 686042
4-[(2R)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidin-2-yl]aniline
CID 1373902
(2R)-2-(2,5-dimethoxyphenyl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine
CID 1143496
3-(3,4-dichlorophenyl)sulfonyl-2-(4-methoxyphenyl)-1,3-thiazolidine
CID 3640975
2-(2,5-dimethoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine
CID 3144172
(2R)-3-(4-chlorophenyl)sulfonyl-2-(2,5-dimethoxyphenyl)-1,3-thiazolidine
CID 1143484
3-(4-fluorophenyl)sulfonyl-2-(2-methoxyphenyl)-1,3-thiazolidine
CID 3144179
2-(3,4-dimethoxyphenyl)-3-(4-phenoxyphenyl)sulfonyl-1,3-thiazolidine
CID 122345675
2-(2-methoxyphenyl)-3-naphthalen-2-ylsulfonyl-1,3-thiazolidine
CID 3383864
(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

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine?
The IUPAC name of (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine (CID 1084382) is (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine.
What is the SMILES notation for (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine?
The canonical SMILES for (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine is COc1ccc(S(=O)(=O)N2CCS[C@H]2c2ccco2)cc1.
What is the InChIKey of (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine?
The InChIKey is GPOKOHIDPJJOOC-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H15NO4S2/c1-18-11-4-6-12(7-5-11)21(16,17)15-8-10-20-14(15)13-3-2-9-19-13/h2-7,9,14H,8,10H2,1H3/t14-/m0/s1.
What are the key properties of (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine?
(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine has a molecular weight of 325.41 g/mol, XLogP of 2.72, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine is sourced from PubChem (CID 1084382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).