2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform

C12H12F3NS — CID 159404933

IUPAC2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform
SMILESCc1nc(C)c(-c2ccccc2)s1.FC(F)F
InChIInChI=1S/C11H11NS.CHF3/c1-8-11(13-9(2)12-8)10-6-4-3-5-7-10;2-1(3)4/h3-7H,1-2H3;1H
InChIKeyLNVGESXCXANROO-UHFFFAOYSA-N
MW259.30 g/mol
LogP4.61
Rot. Bonds1

About 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform

2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform (PubChem CID 159404933) has the molecular formula C12H12F3NS and a molecular weight of 259.30 g/mol. Its IUPAC name is 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform.

Molecular Properties

Compound Name2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform
PubChem CID159404933
Molecular FormulaC12H12F3NS
Molecular Weight259.30 g/mol
Exact Mass259.06
IUPAC Name2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform
SMILESCc1nc(C)c(-c2ccccc2)s1.FC(F)F
InChIInChI=1S/C11H11NS.CHF3/c1-8-11(13-9(2)12-8)10-6-4-3-5-7-10;2-1(3)4/h3-7H,1-2H3;1H
InChIKeyLNVGESXCXANROO-UHFFFAOYSA-N
XLogP4.61
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-2-methyl-5-phenyl-1,3-thiazole
CID 86189921
2,4-dimethyl-5-(3-phenyl-1H-1,2,4-triazol-5-yl)-1,3-thiazole
CID 114034068
2-methyl-4-(4-methylphenyl)-5-phenyl-1,3-thiazole
CID 4654127
2-methyl-5-(4-methylphenyl)-4-phenyl-1,3-thiazole
CID 139241050
2-methyl-5-phenyl-4-propyl-1,3-thiazole
CID 90764041
4-(bromomethyl)-2-methyl-5-phenyl-1,3-thiazole
CID 130090867
2-(chloromethyl)-4-methyl-5-phenyl-1,3-thiazole
CID 114987484
2-methyl-5-phenyl-1,3-thiazole-4-carbaldehyde
CID 15359783
2-methyl-4-[(4-methylphenyl)-phenylmethyl]-5-phenyl-1,3-thiazole
CID 46947499
4-(4-methyl-2-phenyl-1,3-thiazol-5-yl)aniline
CID 58200398
3-[4-(2,4-dimethyl-1,3-thiazol-5-yl)phenyl]propanoic acid
CID 122569718
4-[(4-bromophenyl)-phenylmethyl]-2-methyl-5-phenyl-1,3-thiazole
CID 46947498

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform?
The IUPAC name of 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform (CID 159404933) is 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform.
What is the SMILES notation for 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform?
The canonical SMILES for 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform is Cc1nc(C)c(-c2ccccc2)s1.FC(F)F.
What is the InChIKey of 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform?
The InChIKey is LNVGESXCXANROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NS.CHF3/c1-8-11(13-9(2)12-8)10-6-4-3-5-7-10;2-1(3)4/h3-7H,1-2H3;1H.
What are the key properties of 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform?
2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform has a molecular weight of 259.30 g/mol, XLogP of 4.61, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform is sourced from PubChem (CID 159404933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).