2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine

C15H13ClFNO2S2 — CID 4227891

IUPAC2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine
SMILESO=S(=O)(c1ccc(F)cc1)N1CCSC1c1ccccc1Cl
InChIInChI=1S/C15H13ClFNO2S2/c16-14-4-2-1-3-13(14)15-18(9-10-21-15)22(19,20)12-7-5-11(17)6-8-12/h1-8,15H,9-10H2
InChIKeySAEQDMFZWQJYGQ-UHFFFAOYSA-N
MW357.86 g/mol
LogP3.92
Rot. Bonds3

About 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine

2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine (PubChem CID 4227891) has the molecular formula C15H13ClFNO2S2 and a molecular weight of 357.86 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine
PubChem CID4227891
Molecular FormulaC15H13ClFNO2S2
Molecular Weight357.86 g/mol
Exact Mass357.01
IUPAC Name2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine
SMILESO=S(=O)(c1ccc(F)cc1)N1CCSC1c1ccccc1Cl
InChIInChI=1S/C15H13ClFNO2S2/c16-14-4-2-1-3-13(14)15-18(9-10-21-15)22(19,20)12-7-5-11(17)6-8-12/h1-8,15H,9-10H2
InChIKeySAEQDMFZWQJYGQ-UHFFFAOYSA-N
XLogP3.92
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.86
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-chloro-4-fluorophenyl)methyl]-N-methylthiophene-2-sulfonamide
CID 2536317
N-[(2-chloro-6-fluorophenyl)methyl]-N-methylthiophene-2-sulfonamide
CID 4788611
(2R)-2-(4-chlorophenyl)-3-methylsulfonyl-1,3-thiazolidine
CID 949918
3-(4-Fluorophenyl)sulfonyl-2-phenyl-1,3-thiazolidine
CID 3144178
2-(4-Chlorophenyl)-3-[3-(trifluoromethyl)benzenesulfonyl]-1,3-thiazolidine
CID 4055672
N-[(2-chlorophenyl)methyl]-N-methyl-2-methylsulfonylbenzenesulfonamide
CID 31534305
N-[(2-chloro-4-fluorophenyl)methyl]-N-ethyl-1,1-dioxothiolan-3-amine
CID 53531683
(2-Chloro-5-fluorobenzyl)(1,1-dioxidotetrahydro-3-thienyl)ethylamine
CID 70786210
4-Chloro-1-{[2-(4-fluorophenyl)pyrrolidinyl]sulfonyl}benzene
CID 4106469
2-(4-Chlorophenyl)-3-(methylsulfonyl)-1,3-thiazolidine
CID 3152940
2-(4-Chlorophenyl)-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine
CID 2847064
3-(4-Chlorobenzenesulfonyl)-2-phenyl-1,3-thiazolidine
CID 2847618

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine?
The IUPAC name of 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine (CID 4227891) is 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine.
What is the SMILES notation for 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine?
The canonical SMILES for 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine is O=S(=O)(c1ccc(F)cc1)N1CCSC1c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine?
The InChIKey is SAEQDMFZWQJYGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2S2/c16-14-4-2-1-3-13(14)15-18(9-10-21-15)22(19,20)12-7-5-11(17)6-8-12/h1-8,15H,9-10H2.
What are the key properties of 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine?
2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine has a molecular weight of 357.86 g/mol, XLogP of 3.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-thiazolidine is sourced from PubChem (CID 4227891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).