4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole

C14H15N3OS — CID 139697858

IUPAC4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole
SMILESCC(C)n1cnc(Cc2nc(-c3ccoc3)cs2)c1
InChIInChI=1S/C14H15N3OS/c1-10(2)17-6-12(15-9-17)5-14-16-13(8-19-14)11-3-4-18-7-11/h3-4,6-10H,5H2,1-2H3
InChIKeyYNDOFWYQBHUHMI-UHFFFAOYSA-N
MW273.36 g/mol
LogP3.77
Rot. Bonds4

About 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole

4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole (PubChem CID 139697858) has the molecular formula C14H15N3OS and a molecular weight of 273.36 g/mol. Its IUPAC name is 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole.

Molecular Properties

Compound Name4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole
PubChem CID139697858
Molecular FormulaC14H15N3OS
Molecular Weight273.36 g/mol
Exact Mass273.09
IUPAC Name4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole
SMILESCC(C)n1cnc(Cc2nc(-c3ccoc3)cs2)c1
InChIInChI=1S/C14H15N3OS/c1-10(2)17-6-12(15-9-17)5-14-16-13(8-19-14)11-3-4-18-7-11/h3-4,6-10H,5H2,1-2H3
InChIKeyYNDOFWYQBHUHMI-UHFFFAOYSA-N
XLogP3.77
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-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

4-[[4-(furan-3-ylmethyl)-3,5-dihydro-2H-pyrido[2,3-e][1,4]diazepin-1-yl]methyl]-2-methyl-1,3-thiazole
CID 97520922
5-(2-Methylfuran-3-yl)sulfanyl-6-phenylimidazo[2,1-b][1,3]thiazole
CID 122210710
2-(Furan-2-yl)-4-[[5-phenyl-1-(2,2,2-trifluoroethyl)imidazol-2-yl]sulfanylmethyl]-1,3-thiazole
CID 56237009
N-(furan-3-ylmethyl)-N-[(3-methylimidazol-4-yl)methyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 167940114
[2-[[2-(Furan-3-yl)-1,3-thiazol-4-yl]methylsulfanyl]-3-methylimidazol-4-yl]methanol
CID 71861592
4-(furan-3-yl)-N-(3-methylpyridin-2-yl)thiazol-2-amine hydrochloride
CID 72720208
[4-(3-Furyl)-1,3-thiazol-2-yl]-3-pyridylamine
CID 72720213
4-(furan-3-yl)-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole
CID 86185791
2-[(1-Cyclopropylimidazol-4-yl)methyl]-4-(furan-2-yl)-1,3-thiazole
CID 139697848
4-(Furan-2-yl)-2-[(1-prop-2-enylimidazol-4-yl)methyl]-1,3-thiazole
CID 139697851
2-[(1-Benzylimidazol-4-yl)methyl]-4-(furan-2-yl)-1,3-thiazole;dihydrochloride
CID 139697861
2-[(1-Benzylimidazol-4-yl)methyl]-4-(furan-2-yl)-1,3-thiazole
CID 139697862

Frequently Asked Questions

What is the IUPAC name of 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole?
The IUPAC name of 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole (CID 139697858) is 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole.
What is the SMILES notation for 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole?
The canonical SMILES for 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole is CC(C)n1cnc(Cc2nc(-c3ccoc3)cs2)c1.
What is the InChIKey of 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole?
The InChIKey is YNDOFWYQBHUHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3OS/c1-10(2)17-6-12(15-9-17)5-14-16-13(8-19-14)11-3-4-18-7-11/h3-4,6-10H,5H2,1-2H3.
What are the key properties of 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole?
4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole has a molecular weight of 273.36 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-3-yl)-2-[(1-propan-2-ylimidazol-4-yl)methyl]-1,3-thiazole is sourced from PubChem (CID 139697858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).