N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide

C19H14N4O3S — CID 70941244

IUPACN-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide
SMILESCSc1ccc(-c2cccc(C(=O)Nc3nnc(-c4ccco4)o3)c2)cn1
InChIInChI=1S/C19H14N4O3S/c1-27-16-8-7-14(11-20-16)12-4-2-5-13(10-12)17(24)21-19-23-22-18(26-19)15-6-3-9-25-15/h2-11H,1H3,(H,21,23,24)
InChIKeyMXTNEGYHZMEWLI-UHFFFAOYSA-N
MW378.41 g/mol
LogP4.37
Rot. Bonds5

About N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide

N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide (PubChem CID 70941244) has the molecular formula C19H14N4O3S and a molecular weight of 378.41 g/mol. Its IUPAC name is N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide.

Molecular Properties

Compound NameN-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide
PubChem CID70941244
Molecular FormulaC19H14N4O3S
Molecular Weight378.41 g/mol
Exact Mass378.08
IUPAC NameN-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide
SMILESCSc1ccc(-c2cccc(C(=O)Nc3nnc(-c4ccco4)o3)c2)cn1
InChIInChI=1S/C19H14N4O3S/c1-27-16-8-7-14(11-20-16)12-4-2-5-13(10-12)17(24)21-19-23-22-18(26-19)15-6-3-9-25-15/h2-11H,1H3,(H,21,23,24)
InChIKeyMXTNEGYHZMEWLI-UHFFFAOYSA-N
XLogP4.37
TPSA94.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.41
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide 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-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(4-trimethylsilylphenyl)benzamide
CID 70941246
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-methylsulfanylbenzamide
CID 7266914
3-(3-fluoro-4-phenylphenyl)-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 70941308
3-(4-ethenylphenyl)-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 89120372
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 70941439
tert-butyl 4-[4-[3-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]carbamoyl]phenyl]phenyl]piperazine-1-carboxylate
CID 53327676
3-acetamido-5-[4-(4-ethylphenyl)phenyl]-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 70941259
3-cyano-N-[5-[3-(furan-2-yl)phenyl]-1,3,4-oxadiazol-2-yl]benzamide
CID 177345157
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-4-phenoxybenzamide
CID 4151972
N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-3-methylsulfanylbenzamide
CID 16854802
3-bromo-5-chloro-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 70941202
3-bromo-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide
CID 2231472

Frequently Asked Questions

What is the IUPAC name of N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide?
The IUPAC name of N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide (CID 70941244) is N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide.
What is the SMILES notation for N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide?
The canonical SMILES for N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide is CSc1ccc(-c2cccc(C(=O)Nc3nnc(-c4ccco4)o3)c2)cn1.
What is the InChIKey of N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide?
The InChIKey is MXTNEGYHZMEWLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O3S/c1-27-16-8-7-14(11-20-16)12-4-2-5-13(10-12)17(24)21-19-23-22-18(26-19)15-6-3-9-25-15/h2-11H,1H3,(H,21,23,24).
What are the key properties of N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide?
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide has a molecular weight of 378.41 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-(6-methylsulfanyl-3-pyridinyl)benzamide is sourced from PubChem (CID 70941244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).