4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole

C16H11F2NS — CID 19589589

IUPAC4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole
SMILESCc1ccccc1-c1nc(-c2ccc(F)cc2F)cs1
InChIInChI=1S/C16H11F2NS/c1-10-4-2-3-5-12(10)16-19-15(9-20-16)13-7-6-11(17)8-14(13)18/h2-9H,1H3
InChIKeyNXJOFJROHDLVHN-UHFFFAOYSA-N
MW287.33 g/mol
LogP5.06
Rot. Bonds2

About 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole

4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole (PubChem CID 19589589) has the molecular formula C16H11F2NS and a molecular weight of 287.33 g/mol. Its IUPAC name is 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole
PubChem CID19589589
Molecular FormulaC16H11F2NS
Molecular Weight287.33 g/mol
Exact Mass287.06
IUPAC Name4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole
SMILESCc1ccccc1-c1nc(-c2ccc(F)cc2F)cs1
InChIInChI=1S/C16H11F2NS/c1-10-4-2-3-5-12(10)16-19-15(9-20-16)13-7-6-11(17)8-14(13)18/h2-9H,1H3
InChIKeyNXJOFJROHDLVHN-UHFFFAOYSA-N
XLogP5.06
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.33
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole 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-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]propan-2-amine
CID 61338995
4-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 60642208
1-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]propan-2-one
CID 116966432
5-[4-(2-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methylphenyl)benzoic acid
CID 89470565
[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]-phenylmethanone
CID 63102442
2-[1-(3-fluorophenyl)-5-methyltriazol-4-yl]-4-(2-methylphenyl)-1,3-thiazole
CID 53337595
4-(3-bromophenyl)-2-(2-methylphenyl)-1,3-thiazole
CID 78908720
3-fluoro-N-[[2-(2-methylphenyl)-1,3-thiazol-4-yl]methyl]benzamide
CID 108737461
4-[[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-2-(2-methylphenyl)-1,3-thiazole
CID 22195952
3-[4-(2-methylphenyl)-1,3-thiazol-2-yl]phenol
CID 28942300
4-(dimethoxymethyl)-2-(4-fluoro-2-methylphenyl)-1,3-thiazole
CID 81274426
N-[3-fluoro-4-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 9356448

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole?
The IUPAC name of 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole (CID 19589589) is 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole.
What is the SMILES notation for 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole?
The canonical SMILES for 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole is Cc1ccccc1-c1nc(-c2ccc(F)cc2F)cs1.
What is the InChIKey of 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole?
The InChIKey is NXJOFJROHDLVHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2NS/c1-10-4-2-3-5-12(10)16-19-15(9-20-16)13-7-6-11(17)8-14(13)18/h2-9H,1H3.
What are the key properties of 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole?
4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole has a molecular weight of 287.33 g/mol, XLogP of 5.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-difluorophenyl)-2-(2-methylphenyl)-1,3-thiazole is sourced from PubChem (CID 19589589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).