2-[2-[(Z)-[2-(1-benzofuran-2-yl)-4-oxoquinazolin-3-yl]iminomethyl]phenoxy]acetamide

Formula:C25H18N4O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-[(Z)-[2-(1-benzofuran-2-yl)-4-oxoquinazolin-3-yl]iminomethyl]phenoxy]acetamide is a drug-like molecule.

MolName2-[2-[(Z)-[2-(1-benzofuran-2-yl)-4-oxoquinazolin-3-yl]iminomethyl]phenoxy]acetamide
MolecularFormulaC25H18N4O4
SmilesNC(COc1c(/C=N\N(C(c2cc(cccc3)c3o2)=Nc2c3cccc2)C3=O)cccc1)=O
InChIInChI=1S/C25H18N4O4/c26-23(30)15-32-20-11-5-2-8-17(20)14-27-29-24(22-13-16-7-1-6-12-21(16)33-22)28-19-10-4-3-9-18(19)25(29)31/h1-14H,15H2,(H2,26,30)
InChIKMVKHTTRYCXYQQK-UHFFFAOYSA-N
TotalMolweight438.442
Molweight438.442
MonoisotopicMass438.132806
CLogP3.2863
CLogS-5.852
H Acceptors8
H Donors1
TotalSurfaceArea329.38
Relative PSA0.2794
PolarSurfaceArea110.49
Druglikeness4.3499
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.45455
Fragments1
Non HAtoms33
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms21
Sp3Atoms2
Amides1
StereoCon

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