4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole

C25H24N2S — CID 159855197

IUPAC4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole
SMILESCCCc1cc(-c2nc(-c3ccc(CCc4ccccc4)cc3)cs2)ccn1
InChIInChI=1S/C25H24N2S/c1-2-6-23-17-22(15-16-26-23)25-27-24(18-28-25)21-13-11-20(12-14-21)10-9-19-7-4-3-5-8-19/h3-5,7-8,11-18H,2,6,9-10H2,1H3
InChIKeySHJRFEYEEKOJLI-UHFFFAOYSA-N
MW384.55 g/mol
LogP6.61
Rot. Bonds7

About 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole

4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole (PubChem CID 159855197) has the molecular formula C25H24N2S and a molecular weight of 384.55 g/mol. Its IUPAC name is 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole
PubChem CID159855197
Molecular FormulaC25H24N2S
Molecular Weight384.55 g/mol
Exact Mass384.17
IUPAC Name4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole
SMILESCCCc1cc(-c2nc(-c3ccc(CCc4ccccc4)cc3)cs2)ccn1
InChIInChI=1S/C25H24N2S/c1-2-6-23-17-22(15-16-26-23)25-27-24(18-28-25)21-13-11-20(12-14-21)10-9-19-7-4-3-5-8-19/h3-5,7-8,11-18H,2,6,9-10H2,1H3
InChIKeySHJRFEYEEKOJLI-UHFFFAOYSA-N
XLogP6.61
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.55
LogP ≤ 56.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-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

N-benzyl-4-[2-(2-propyl-4-pyridinyl)-1,3-thiazol-4-yl]aniline
CID 25012899
N,N-dimethyl-2-[4-[2-(2-propyl-4-pyridinyl)-1,3-thiazol-4-yl]phenoxy]ethanamine
CID 118709521
N-methyl-4-[2-(2-propyl-4-pyridinyl)-1,3-thiazol-4-yl]-N-(trifluoromethylsulfanyl)aniline
CID 134549821
2-[4-[2-(2-propyl-4-pyridinyl)-1,3-thiazol-4-yl]phenyl]quinoline-8-sulfonamide
CID 141218719
2-methyl-4-[4-(2-phenylethyl)phenyl]-1,3-thiazole
CID 174868608
4-[4-(4-propylphenyl)-1,3-thiazol-2-yl]aniline
CID 43667849
ethane;4-[4-(2-iodoethyl)phenyl]-2-phenyl-1,3-thiazole
CID 54249717
2-[2-(methoxymethyl)-4-pyridinyl]-4-(4-methylphenyl)-1,3-thiazole
CID 145149584
N-benzyl-2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]acetamide
CID 9233048
[3-[4-(4-methylphenyl)-1,3-thiazol-2-yl]phenyl]methanamine
CID 20983736
2-propyl-4-[2-(2-propyl-4-pyridinyl)ethyl]pyridine
CID 139918723
4-[2-(4-methylphenyl)ethyl]-2-phenyl-1,3-thiazole
CID 155185709

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole?
The IUPAC name of 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole (CID 159855197) is 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole?
The canonical SMILES for 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole is CCCc1cc(-c2nc(-c3ccc(CCc4ccccc4)cc3)cs2)ccn1.
What is the InChIKey of 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole?
The InChIKey is SHJRFEYEEKOJLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2S/c1-2-6-23-17-22(15-16-26-23)25-27-24(18-28-25)21-13-11-20(12-14-21)10-9-19-7-4-3-5-8-19/h3-5,7-8,11-18H,2,6,9-10H2,1H3.
What are the key properties of 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole?
4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole has a molecular weight of 384.55 g/mol, XLogP of 6.61, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-phenylethyl)phenyl]-2-(2-propyl-4-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 159855197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).