2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide

C19H16N4O3S — CID 47045926

IUPAC2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide
SMILESCn1ccnc1COc1ccc(NC(=O)c2csc(-c3ccco3)n2)cc1
InChIInChI=1S/C19H16N4O3S/c1-23-9-8-20-17(23)11-26-14-6-4-13(5-7-14)21-18(24)15-12-27-19(22-15)16-3-2-10-25-16/h2-10,12H,11H2,1H3,(H,21,24)
InChIKeyBVMABVFTXMGWGQ-UHFFFAOYSA-N
MW380.43 g/mol
LogP3.97
Rot. Bonds6

About 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide

2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide (PubChem CID 47045926) has the molecular formula C19H16N4O3S and a molecular weight of 380.43 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide
PubChem CID47045926
Molecular FormulaC19H16N4O3S
Molecular Weight380.43 g/mol
Exact Mass380.09
IUPAC Name2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide
SMILESCn1ccnc1COc1ccc(NC(=O)c2csc(-c3ccco3)n2)cc1
InChIInChI=1S/C19H16N4O3S/c1-23-9-8-20-17(23)11-26-14-6-4-13(5-7-14)21-18(24)15-12-27-19(22-15)16-3-2-10-25-16/h2-10,12H,11H2,1H3,(H,21,24)
InChIKeyBVMABVFTXMGWGQ-UHFFFAOYSA-N
XLogP3.97
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.43
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide (CID 47045926) is 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide is Cn1ccnc1COc1ccc(NC(=O)c2csc(-c3ccco3)n2)cc1.
What is the InChIKey of 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide?
The InChIKey is BVMABVFTXMGWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3S/c1-23-9-8-20-17(23)11-26-14-6-4-13(5-7-14)21-18(24)15-12-27-19(22-15)16-3-2-10-25-16/h2-10,12H,11H2,1H3,(H,21,24).
What are the key properties of 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide has a molecular weight of 380.43 g/mol, XLogP of 3.97, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 47045926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).