(8Z)-8-benzylidene-4-phenyl-1,3,4,5-tetrahydrothiopyrano[4,3-d]pyrimidine-2-thione

Formula:C20H18N2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (8Z)-8-benzylidene-4-phenyl-1,3,4,5-tetrahydrothiopyrano[4,3-d]pyrimidine-2-thione is a drug-like molecule.

MolName	(8Z)-8-benzylidene-4-phenyl-1,3,4,5-tetrahydrothiopyrano[4,3-d]pyrimidine-2-thione
MolecularFormula	C20H18N2S2
Smiles	S=C1NC(/C(/CSC2)=C/c3ccccc3)=C2C(c2ccccc2)N1
InChI	InChI=1S/C20H18N2S2/c23-20-21-18(15-9-5-2-6-10-15)17-13-24-12-16(19(17)22-20)11-14-7-3-1-4-8-14/h1-11,18H,12-13H2,(H2,21,22,23)/t18-/m0/s1
InChIK	CSBPYIQKOFCNHJ-SFHVURJKSA-N
TotalMolweight	350.509
Molweight	350.509
MonoisotopicMass	350.091138
CLogP	3.8919
CLogS	-4.645
H Acceptors	2
H Donors	2
TotalSurfaceArea	266.79
Relative PSA	0.25642
PolarSurfaceArea	81.45
Druglikeness	1.2413
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.54167
Fragments	1
Non HAtoms	24
NonCHAtoms	4
Electronegative Atoms	4
StereoCenters	1
Rotatable Bond	2
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	4
StereoCon	racemate

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