(5Z)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-phenylethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

Formula:C22H15N3O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-phenylethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is a drug-like molecule.

MolName	(5Z)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-phenylethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
MolecularFormula	C22H15N3O2S
Smiles	O=C1n2nc(/C=C/c3ccccc3)nc2S/C1=C\C1=Cc(cccc2)c2OC1
InChI	InChI=1S/C22H15N3O2S/c26-21-19(13-16-12-17-8-4-5-9-18(17)27-14-16)28-22-23-20(24-25(21)22)11-10-15-6-2-1-3-7-15/h1-13H,14H2
InChIK	DCSWNENIKPWPKD-UHFFFAOYSA-N
TotalMolweight	385.446
Molweight	385.446
MonoisotopicMass	385.088497
CLogP	4.2191
CLogS	-5.125
H Acceptors	5
TotalSurfaceArea	287.42
Relative PSA	0.24125
PolarSurfaceArea	82.31
Druglikeness	4.345
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64286
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	3
StereoCon

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1 - (5Z)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-phenylethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one | 2 - (5Z)-5-(2H-chromen-3-ylmethylidene)-2-[(E)-2-phenylethenyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

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