C18H13N3O3S | Cheminformatics

N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide

Formula:C18H13N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide is a drug-like molecule.

MolNameN-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide
MolecularFormulaC18H13N3O3S
SmilesO=C(Cc1cccs1)Nc1cc(-c2nnc(-c3ccco3)o2)ccc1
InChIInChI=1S/C18H13N3O3S/c22-16(11-14-6-3-9-25-14)19-13-5-1-4-12(10-13)17-20-21-18(24-17)15-7-2-8-23-15/h1-10H,11H2,(H,19,22)
InChIKHHFFXMSUGKOOFR-UHFFFAOYSA-N
TotalMolweight351.385
Molweight351.385
MonoisotopicMass351.067762
CLogP3.3656
CLogS-6.327
H Acceptors6
H Donors1
TotalSurfaceArea268.35
Relative PSA0.35409
PolarSurfaceArea109.4
Druglikeness3.9903
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.6
Fragments1
Non HAtoms25
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms21
Sp3Atoms1
Amides1
Aromatic Nitrogens2
StereoCon

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