4-chloro-N-[(Z)-(2-chloro-4-oxopyrido[1,2-a]pyrimidin-3-yl)methylideneamino]benzamide

Formula:C16H10N4O2Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 4-chloro-N-[(Z)-(2-chloro-4-oxopyrido[1,2-a]pyrimidin-3-yl)methylideneamino]benzamide is a drug-like molecule.

MolName	4-chloro-N-[(Z)-(2-chloro-4-oxopyrido[1,2-a]pyrimidin-3-yl)methylideneamino]benzamide
MolecularFormula	C16H10N4O2Cl2
Smiles	O=C(c(cc1)ccc1Cl)N/N=C\C(C(N(C=CC=C1)C1=N1)=O)=C1Cl
InChI	InChI=1S/C16H10Cl2N4O2/c17-11-6-4-10(5-7-11)15(23)21-19-9-12-14(18)20-13-3-1-2-8-22(13)16(12)24/h1-9H,(H,21,23)
InChIK	NZODTQHDSMEEEQ-UHFFFAOYSA-N
TotalMolweight	361.187
Molweight	361.187
MonoisotopicMass	360.01808
CLogP	1.8433
CLogS	-4.525
H Acceptors	6
H Donors	1
TotalSurfaceArea	258.01
Relative PSA	0.24848
PolarSurfaceArea	74.13
Druglikeness	6.5775
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polar activated DB; twice activated DB; acyl-hydrazone; imine/hydrazone of aldehyde; 3-halo-enone
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Symmetricatoms	2
Amides	1
BasicNitrogens	1
StereoCon

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