N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide

C16H10N2O2S — CID 16858046

IUPACN-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccc2ncsc2c1)c1cc2ccccc2o1
InChIInChI=1S/C16H10N2O2S/c19-16(14-7-10-3-1-2-4-13(10)20-14)18-11-5-6-12-15(8-11)21-9-17-12/h1-9H,(H,18,19)
InChIKeyXJFKOPGJNDJMLG-UHFFFAOYSA-N
MW294.34 g/mol
LogP4.29
Rot. Bonds2

About N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide

N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide (PubChem CID 16858046) has the molecular formula C16H10N2O2S and a molecular weight of 294.34 g/mol. Its IUPAC name is N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide
PubChem CID16858046
Molecular FormulaC16H10N2O2S
Molecular Weight294.34 g/mol
Exact Mass294.05
IUPAC NameN-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccc2ncsc2c1)c1cc2ccccc2o1
InChIInChI=1S/C16H10N2O2S/c19-16(14-7-10-3-1-2-4-13(10)20-14)18-11-5-6-12-15(8-11)21-9-17-12/h1-9H,(H,18,19)
InChIKeyXJFKOPGJNDJMLG-UHFFFAOYSA-N
XLogP4.29
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.34
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide 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-(1,3-benzothiazol-6-yl)-5-chlorofuran-2-carboxamide
CID 113223158
N-dibenzofuran-2-yl-1,3-benzothiazole-6-carboxamide
CID 16552316
N-(3-bromophenyl)-1-benzofuran-2-carboxamide
CID 802478
N-(1,3-benzothiazol-6-yl)-3,5-dihydroxybenzamide
CID 104938868
N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
CID 1016193
N-(4-iodophenyl)-1-benzofuran-2-carboxamide
CID 986281
N-(3-amino-4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 24708217
N-[3-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
CID 1232080
2-(1-aminoethyl)-N-(1,3-benzothiazol-6-yl)-1,3-thiazole-4-carboxamide
CID 107805126
N-(4-sulfamoylphenyl)-1-benzofuran-2-carboxamide
CID 744283
N-(1,3-benzothiazol-6-yl)-4-methylbenzamide
CID 2337792
6-amino-N-(1,3-benzothiazol-6-yl)pyridazine-3-carboxamide
CID 107801365

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide (CID 16858046) is N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide is O=C(Nc1ccc2ncsc2c1)c1cc2ccccc2o1.
What is the InChIKey of N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide?
The InChIKey is XJFKOPGJNDJMLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O2S/c19-16(14-7-10-3-1-2-4-13(10)20-14)18-11-5-6-12-15(8-11)21-9-17-12/h1-9H,(H,18,19).
What are the key properties of N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide?
N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide has a molecular weight of 294.34 g/mol, XLogP of 4.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 16858046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).