5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole

C23H19NS — CID 140714930

IUPAC5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole
SMILESCc1cc(-c2ccccc2)cc(C)c1-c1cnc(-c2ccccc2)s1
InChIInChI=1S/C23H19NS/c1-16-13-20(18-9-5-3-6-10-18)14-17(2)22(16)21-15-24-23(25-21)19-11-7-4-8-12-19/h3-15H,1-2H3
InChIKeyNQVNBQUDDTXYES-UHFFFAOYSA-N
MW341.48 g/mol
LogP6.76
Rot. Bonds3

About 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole

5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole (PubChem CID 140714930) has the molecular formula C23H19NS and a molecular weight of 341.48 g/mol. Its IUPAC name is 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole.

Molecular Properties

Compound Name5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole
PubChem CID140714930
Molecular FormulaC23H19NS
Molecular Weight341.48 g/mol
Exact Mass341.12
IUPAC Name5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole
SMILESCc1cc(-c2ccccc2)cc(C)c1-c1cnc(-c2ccccc2)s1
InChIInChI=1S/C23H19NS/c1-16-13-20(18-9-5-3-6-10-18)14-17(2)22(16)21-15-24-23(25-21)19-11-7-4-8-12-19/h3-15H,1-2H3
InChIKeyNQVNBQUDDTXYES-UHFFFAOYSA-N
XLogP6.76
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.48
LogP ≤ 56.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2-phenyl-1,3-thiazine-6-thione
CID 13358812
5-(4-chlorophenyl)-2-phenyl-1,3-thiazole
CID 101443473
2-(3-tert-butylphenyl)-5-phenyl-1,3-thiazole
CID 122594500
5-(4-chloro-3-methylphenyl)-2-(4-chlorophenyl)-1,3-thiazole
CID 670934
4-(5-phenyl-1,3-thiazol-2-yl)benzenesulfonic acid
CID 88788376
2-naphthalen-2-yl-5-phenyl-1,3-thiazole
CID 90384723
2-(2-phenyl-1,3-thiazol-5-yl)-1,3-oxazole
CID 173298635
5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole
CID 140714662
N-methylidene-N'-[2-methyl-4-(2-phenyl-1,3-thiazol-5-yl)phenyl]pyridine-3-carboximidamide
CID 144501112
3-hydroxy-4-methyl-5-(2-phenyl-1,3-thiazol-5-yl)pyridine-2-carboxylic acid
CID 162731592
3-[2,6-dimethyl-4-(4-methylphenyl)phenyl]-5-methyl-2-phenylpyridine
CID 170237029
5-[3-[3,5-dimethyl-4-(3,4,5-trimethylphenyl)phenyl]-5-phenylphenyl]-1,3-dimethyl-2-(3,4,5-trimethylphenyl)benzene;ethane
CID 123394751

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole?
The IUPAC name of 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole (CID 140714930) is 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole.
What is the SMILES notation for 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole?
The canonical SMILES for 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole is Cc1cc(-c2ccccc2)cc(C)c1-c1cnc(-c2ccccc2)s1.
What is the InChIKey of 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole?
The InChIKey is NQVNBQUDDTXYES-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NS/c1-16-13-20(18-9-5-3-6-10-18)14-17(2)22(16)21-15-24-23(25-21)19-11-7-4-8-12-19/h3-15H,1-2H3.
What are the key properties of 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole?
5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole has a molecular weight of 341.48 g/mol, XLogP of 6.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole is sourced from PubChem (CID 140714930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).