5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide

C18H13N3O2S — CID 121395569

IUPAC5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(Sc2nc3ccccc3[nH]2)o1
InChIInChI=1S/C18H13N3O2S/c22-17(19-12-6-2-1-3-7-12)15-10-11-16(23-15)24-18-20-13-8-4-5-9-14(13)21-18/h1-11H,(H,19,22)(H,20,21)
InChIKeySKYAZIXBICHPKV-UHFFFAOYSA-N
MW335.39 g/mol
LogP4.56
Rot. Bonds4

About 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide

5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide (PubChem CID 121395569) has the molecular formula C18H13N3O2S and a molecular weight of 335.39 g/mol. Its IUPAC name is 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide.

Molecular Properties

Compound Name5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide
PubChem CID121395569
Molecular FormulaC18H13N3O2S
Molecular Weight335.39 g/mol
Exact Mass335.07
IUPAC Name5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(Sc2nc3ccccc3[nH]2)o1
InChIInChI=1S/C18H13N3O2S/c22-17(19-12-6-2-1-3-7-12)15-10-11-16(23-15)24-18-20-13-8-4-5-9-14(13)21-18/h1-11H,(H,19,22)(H,20,21)
InChIKeySKYAZIXBICHPKV-UHFFFAOYSA-N
XLogP4.56
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.39
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-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

5-(1H-benzimidazol-2-ylsulfanyl)furan-2-carboxylic acid
CID 62206739
5-(1H-benzimidazol-2-ylsulfanyl)furan-2-carboxylic acid;ethane
CID 145098806
5-(1H-benzimidazol-2-ylsulfanyl)furan-2-carbaldehyde
CID 698427
(Z)-3-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-2-cyano-N-(4-methylphenyl)prop-2-enamide
CID 21212311
4-(1H-benzimidazol-2-ylsulfanylmethyl)-N'-phenylbenzohydrazide
CID 78774579
N'-(1H-benzimidazol-2-ylsulfanyl)-N-phenylbutanediamide
CID 88644572
1-[5-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]furan-2-yl]ethanone
CID 104651931
N-[(Z)-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]methylideneamino]naphthalene-1-carboxamide
CID 126189660
N'-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]-5-methylfuran-2-carbohydrazide
CID 29410900
N-[[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]methylideneamino]-2-methoxybenzamide
CID 3525797
2-[(4E)-4-[[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]methylidene]-2,5-dioxoimidazolidin-1-yl]-N-(4-methylphenyl)acetamide
CID 21215920
N-[3-(1H-benzimidazol-2-yl)phenyl]-1-benzofuran-2-carboxamide
CID 1108445

Frequently Asked Questions

What is the IUPAC name of 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide?
The IUPAC name of 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide (CID 121395569) is 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide.
What is the SMILES notation for 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide?
The canonical SMILES for 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide is O=C(Nc1ccccc1)c1ccc(Sc2nc3ccccc3[nH]2)o1.
What is the InChIKey of 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide?
The InChIKey is SKYAZIXBICHPKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O2S/c22-17(19-12-6-2-1-3-7-12)15-10-11-16(23-15)24-18-20-13-8-4-5-9-14(13)21-18/h1-11H,(H,19,22)(H,20,21).
What are the key properties of 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide?
5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide has a molecular weight of 335.39 g/mol, XLogP of 4.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-benzimidazol-2-ylsulfanyl)-N-phenylfuran-2-carboxamide is sourced from PubChem (CID 121395569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).