(2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one

C21H16BrNO2S — CID 27566937

IUPAC(2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one
SMILESO=C1CS[C@H](c2ccc(Br)cc2)N1c1ccccc1Oc1ccccc1
InChIInChI=1S/C21H16BrNO2S/c22-16-12-10-15(11-13-16)21-23(20(24)14-26-21)18-8-4-5-9-19(18)25-17-6-2-1-3-7-17/h1-13,21H,14H2/t21-/m1/s1
InChIKeyVLTSSYSKMOYJGH-OAQYLSRUSA-N
MW426.34 g/mol
LogP6.02
Rot. Bonds4

About (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one

(2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one (PubChem CID 27566937) has the molecular formula C21H16BrNO2S and a molecular weight of 426.34 g/mol. Its IUPAC name is (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one
PubChem CID27566937
Molecular FormulaC21H16BrNO2S
Molecular Weight426.34 g/mol
Exact Mass425.01
IUPAC Name(2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one
SMILESO=C1CS[C@H](c2ccc(Br)cc2)N1c1ccccc1Oc1ccccc1
InChIInChI=1S/C21H16BrNO2S/c22-16-12-10-15(11-13-16)21-23(20(24)14-26-21)18-8-4-5-9-19(18)25-17-6-2-1-3-7-17/h1-13,21H,14H2/t21-/m1/s1
InChIKeyVLTSSYSKMOYJGH-OAQYLSRUSA-N
XLogP6.02
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.34
LogP ≤ 56.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one 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

(2S)-3-(2-phenoxyphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 27566922
(2S)-3-(4-phenoxyphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 6935175
(2R)-3-(4-methoxyphenyl)-2-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 1274265
(2R)-3-(4-ethoxyphenyl)-2-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 1274921
3-(4-bromophenyl)-2-(4-methoxyphenyl)-1,3-thiazolidin-4-one
CID 3858882
(2S)-2-(4-bromophenyl)-3-(4-methylphenyl)-1,3-thiazolidin-4-one
CID 690197
(2S)-3-[4-[(2S)-4-oxo-2-phenyl-1,3-thiazolidin-3-yl]phenyl]-2-phenyl-1,3-thiazolidin-4-one
CID 1041463
2-(4-methoxyphenyl)-3-phenyl-1,3-thiazolidin-4-one
CID 2839840
3-(4-bromoanilino)-2-phenyl-1,3-thiazolidin-4-one
CID 3057291
N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide
CID 42807105
3-(1,3-benzothiazol-2-yl)-2-(4-bromophenyl)-1,3-thiazolidin-4-one
CID 3332829
2-[3-(bromomethyl)phenyl]-3-(2-methoxyphenyl)-1,3-thiazolidin-4-one
CID 71511614

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one?
The IUPAC name of (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one (CID 27566937) is (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one?
The canonical SMILES for (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one is O=C1CS[C@H](c2ccc(Br)cc2)N1c1ccccc1Oc1ccccc1.
What is the InChIKey of (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one?
The InChIKey is VLTSSYSKMOYJGH-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H16BrNO2S/c22-16-12-10-15(11-13-16)21-23(20(24)14-26-21)18-8-4-5-9-19(18)25-17-6-2-1-3-7-17/h1-13,21H,14H2/t21-/m1/s1.
What are the key properties of (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one?
(2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one has a molecular weight of 426.34 g/mol, XLogP of 6.02, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-bromophenyl)-3-(2-phenoxyphenyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 27566937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).