[(Z)-(8-chloro-4H-thieno[3,2-c]chromen-2-yl)methylideneamino]thiourea

Formula:C13H10N3OClS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(Z)-(8-chloro-4H-thieno[3,2-c]chromen-2-yl)methylideneamino]thiourea is a drug-like molecule.

MolName	[(Z)-(8-chloro-4H-thieno[3,2-c]chromen-2-yl)methylideneamino]thiourea
MolecularFormula	C13H10N3OClS2
Smiles	NC(N/N=C\c1cc(COc(cc2)c-3cc2Cl)c3s1)=S
InChI	InChI=1S/C13H10ClN3OS2/c14-8-1-2-11-10(4-8)12-7(6-18-11)3-9(20-12)5-16-17-13(15)19/h1-5H,6H2,(H3,15,17,19)
InChIK	OFQPHOWRILATLT-UHFFFAOYSA-N
TotalMolweight	323.827
Molweight	323.827
MonoisotopicMass	322.995379
CLogP	3.4032
CLogS	-6.006
H Acceptors	4
H Donors	2
TotalSurfaceArea	232.09
Relative PSA	0.41622
PolarSurfaceArea	119.97
Druglikeness	3.502
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde; thio-amide/urea
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
StereoCon

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