(2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine

C21H18ClNO2S2 — CID 7574021

IUPAC(2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
SMILESO=S(=O)(c1ccc(-c2ccccc2)cc1)N1CCS[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C21H18ClNO2S2/c22-19-8-4-7-18(15-19)21-23(13-14-26-21)27(24,25)20-11-9-17(10-12-20)16-5-2-1-3-6-16/h1-12,15,21H,13-14H2/t21-/m1/s1
InChIKeyXKCHFFKDLOQQQN-OAQYLSRUSA-N
MW415.97 g/mol
LogP5.44
Rot. Bonds4

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

(2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine (PubChem CID 7574021) has the molecular formula C21H18ClNO2S2 and a molecular weight of 415.97 g/mol. Its IUPAC name is (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine.

Molecular Properties

Compound Name(2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
PubChem CID7574021
Molecular FormulaC21H18ClNO2S2
Molecular Weight415.97 g/mol
Exact Mass415.05
IUPAC Name(2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
SMILESO=S(=O)(c1ccc(-c2ccccc2)cc1)N1CCS[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C21H18ClNO2S2/c22-19-8-4-7-18(15-19)21-23(13-14-26-21)27(24,25)20-11-9-17(10-12-20)16-5-2-1-3-6-16/h1-12,15,21H,13-14H2/t21-/m1/s1
InChIKeyXKCHFFKDLOQQQN-OAQYLSRUSA-N
XLogP5.44
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.97
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-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

2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 23938405
(2S)-2-(3-chlorophenyl)-3-(4-iodophenyl)sulfonyl-1,3-thiazolidine
CID 41316900
(2R)-2-(3-chlorophenyl)-3-(4-iodophenyl)sulfonyl-1,3-thiazolidine
CID 41316899
2-(2,4-dichlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 23945588
(2S)-2-(3-nitrophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 2055915
2-(3-nitrophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 2877097
(2R)-3-(4-butoxyphenyl)sulfonyl-2-(3-chlorophenyl)-1,3-thiazolidine
CID 40548155
2-(3-chlorophenyl)-3-(4-methyl-3,5-dinitrophenyl)sulfonyl-1,3-thiazolidine
CID 45076759
(2S)-3-(benzenesulfonyl)-2-(4-chloro-3-nitrophenyl)-1,3-thiazolidine
CID 1118518
(2S)-3-(4-iodophenyl)sulfonyl-2-phenyl-1,3-thiazolidine
CID 40837132
3-(4-iodophenyl)sulfonyl-2-phenyl-1,3-thiazolidine
CID 3309477
3-naphthalen-2-ylsulfonyl-2-phenyl-1,3-thiazolidine
CID 2848104

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine?
The IUPAC name of (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine (CID 7574021) is (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine.
What is the SMILES notation for (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine?
The canonical SMILES for (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine is O=S(=O)(c1ccc(-c2ccccc2)cc1)N1CCS[C@@H]1c1cccc(Cl)c1.
What is the InChIKey of (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine?
The InChIKey is XKCHFFKDLOQQQN-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H18ClNO2S2/c22-19-8-4-7-18(15-19)21-23(13-14-26-21)27(24,25)20-11-9-17(10-12-20)16-5-2-1-3-6-16/h1-12,15,21H,13-14H2/t21-/m1/s1.
What are the key properties of (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine?
(2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine has a molecular weight of 415.97 g/mol, XLogP of 5.44, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine is sourced from PubChem (CID 7574021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).