(2Z)-2-benzylidene-5-(1,3-diphenylpyrazol-4-yl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-one

Formula:C34H24N4OS Mutagenic:none Tumorigenic:none Reproductive Effective:none (2Z)-2-benzylidene-5-(1,3-diphenylpyrazol-4-yl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-one is not a drug-like molecule.

MolName	(2Z)-2-benzylidene-5-(1,3-diphenylpyrazol-4-yl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-one
MolecularFormula	C34H24N4OS
Smiles	O=C(/C(/S1)=C/c2ccccc2)N2C1=NC(c1ccccc1)=CC2c1cn(-c2ccccc2)nc1-c1ccccc1
InChI	InChI=1S/C34H24N4OS/c39-33-31(21-24-13-5-1-6-14-24)40-34-35-29(25-15-7-2-8-16-25)22-30(38(33)34)28-23-37(27-19-11-4-12-20-27)36-32(28)26-17-9-3-10-18-26/h1-23,30H/t30-/m1/s1
InChIK	UTDAUEDCRHVDSV-SSEXGKCCSA-N
TotalMolweight	536.658
Molweight	536.658
MonoisotopicMass	536.167081
CLogP	6.1964
CLogS	-7.176
H Acceptors	5
TotalSurfaceArea	403.69
Relative PSA	0.15713
PolarSurfaceArea	75.79
Druglikeness	5.4751
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.4
Fragments	1
Non HAtoms	40
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	5
Rings Closures	7
Small Rings	7
Aromatic Rings	5
Aromatic Atoms	29
Sp3Atoms	2
Symmetricatoms	8
Amides	1
Aromatic Nitrogens	2
StereoCon	racemate

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