2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one

C15H10BrF2NOS — CID 3574457

IUPAC2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccccc2Br)N1c1ccc(F)cc1F
InChIInChI=1S/C15H10BrF2NOS/c16-11-4-2-1-3-10(11)15-19(14(20)8-21-15)13-6-5-9(17)7-12(13)18/h1-7,15H,8H2
InChIKeyMSZLMJRCOKLHQW-UHFFFAOYSA-N
MW370.22 g/mol
LogP4.51
Rot. Bonds2

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

2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one (PubChem CID 3574457) has the molecular formula C15H10BrF2NOS and a molecular weight of 370.22 g/mol. Its IUPAC name is 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one
PubChem CID3574457
Molecular FormulaC15H10BrF2NOS
Molecular Weight370.22 g/mol
Exact Mass368.96
IUPAC Name2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccccc2Br)N1c1ccc(F)cc1F
InChIInChI=1S/C15H10BrF2NOS/c16-11-4-2-1-3-10(11)15-19(14(20)8-21-15)13-6-5-9(17)7-12(13)18/h1-7,15H,8H2
InChIKeyMSZLMJRCOKLHQW-UHFFFAOYSA-N
XLogP4.51
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.22
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one (CID 3574457) is 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one is O=C1CSC(c2ccccc2Br)N1c1ccc(F)cc1F.
What is the InChIKey of 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one?
The InChIKey is MSZLMJRCOKLHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrF2NOS/c16-11-4-2-1-3-10(11)15-19(14(20)8-21-15)13-6-5-9(17)7-12(13)18/h1-7,15H,8H2.
What are the key properties of 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one?
2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one has a molecular weight of 370.22 g/mol, XLogP of 4.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-3-(2,4-difluorophenyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 3574457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).