2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide

Formula:C23H15N4O2Cl3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide is not a drug-like molecule.

MolName	2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide
MolecularFormula	C23H15N4O2Cl3S
Smiles	O=C(CSC(N1c(cc2)ccc2Cl)=Nc(cccc2)c2C1=O)N/N=C\c(ccc(Cl)c1)c1Cl
InChI	InChI=1S/C23H15Cl3N4O2S/c24-15-7-9-17(10-8-15)30-22(32)18-3-1-2-4-20(18)28-23(30)33-13-21(31)29-27-12-14-5-6-16(25)11-19(14)26/h1-12H,13H2,(H,29,31)
InChIK	AWVXENOGCYHOHQ-UHFFFAOYSA-N
TotalMolweight	517.823
Molweight	517.823
MonoisotopicMass	515.998127
CLogP	6.0285
CLogS	-8.333
H Acceptors	6
H Donors	1
TotalSurfaceArea	361.78
Relative PSA	0.22555
PolarSurfaceArea	99.43
Druglikeness	5.7508
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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