4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine

C18H14N2O2S — CID 684498

IUPAC4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccccc1Nc1nc(-c2cc3ccccc3o2)cs1
InChIInChI=1S/C18H14N2O2S/c1-21-16-9-5-3-7-13(16)19-18-20-14(11-23-18)17-10-12-6-2-4-8-15(12)22-17/h2-11H,1H3,(H,19,20)
InChIKeySKLHZLIYMUTVEI-UHFFFAOYSA-N
MW322.39 g/mol
LogP5.31
Rot. Bonds4

About 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine

4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 684498) has the molecular formula C18H14N2O2S and a molecular weight of 322.39 g/mol. Its IUPAC name is 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
PubChem CID684498
Molecular FormulaC18H14N2O2S
Molecular Weight322.39 g/mol
Exact Mass322.08
IUPAC Name4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccccc1Nc1nc(-c2cc3ccccc3o2)cs1
InChIInChI=1S/C18H14N2O2S/c1-21-16-9-5-3-7-13(16)19-18-20-14(11-23-18)17-10-12-6-2-4-8-15(12)22-17/h2-11H,1H3,(H,19,20)
InChIKeySKLHZLIYMUTVEI-UHFFFAOYSA-N
XLogP5.31
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.39
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine 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

6-methoxy-3-[2-(2-methoxyanilino)-1,3-thiazol-4-yl]chromen-2-one
CID 1253888
N-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]-7-methoxy-1-benzofuran-2-carboxamide
CID 40946611
N-(2-methoxyphenyl)-4-(4-phenylphenyl)-1,3-thiazol-2-amine
CID 2303545
N-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]-2,3-dimethoxybenzamide
CID 8702490
4-imidazo[1,2-a]pyrazin-3-yl-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
CID 86674181
2-(1-benzofuran-2-yl)-8-methoxyimidazo[1,2-a]pyridine
CID 115404746
ethyl 2-[[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]amino]-4,5-dimethylthiophene-3-carboxylate
CID 2467742
5-(1-benzofuran-2-yl)-3-(2-methoxyphenyl)-1,2-oxazole
CID 99964755
N-[4-[2-(2-methoxyanilino)-1,3-thiazol-4-yl]phenyl]-N-methylmethanesulfonamide
CID 9343584
methyl 3-[3-[2-(2-methoxyanilino)-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]propanoate
CID 8962499
2-[3-[2-(2-methoxyanilino)-1,3-thiazol-4-yl]phenyl]isoindole-1,3-dione;hydrobromide
CID 2839813
N-[2-methoxy-4-[3-methoxy-4-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]phenyl]phenyl]-4-(4-methylphenyl)-1,3-thiazol-2-amine
CID 127037256

Frequently Asked Questions

What is the IUPAC name of 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine (CID 684498) is 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine is COc1ccccc1Nc1nc(-c2cc3ccccc3o2)cs1.
What is the InChIKey of 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is SKLHZLIYMUTVEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2S/c1-21-16-9-5-3-7-13(16)19-18-20-14(11-23-18)17-10-12-6-2-4-8-15(12)22-17/h2-11H,1H3,(H,19,20).
What are the key properties of 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 322.39 g/mol, XLogP of 5.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-benzofuran-2-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 684498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).