[4-[(Z)-[[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate

Formula:C24H16N5O4BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate is not a drug-like molecule.

MolName	[4-[(Z)-[[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate
MolecularFormula	C24H16N5O4BrS
Smiles	O=C(C(N/N=C\c(cc1)ccc1OC(c(cc1)ccc1Br)=O)=O)Nc1nnc(-c2ccccc2)s1
InChI	InChI=1S/C24H16BrN5O4S/c25-18-10-8-17(9-11-18)23(33)34-19-12-6-15(7-13-19)14-26-28-21(32)20(31)27-24-30-29-22(35-24)16-4-2-1-3-5-16/h1-14H,(H,28,32)(H,27,30,31)
InChIK	LBNQCENZJVNENV-UHFFFAOYSA-N
TotalMolweight	550.392
Molweight	550.392
MonoisotopicMass	549.010636
CLogP	4.9676
CLogS	-6.333
H Acceptors	9
H Donors	2
TotalSurfaceArea	375.56
Relative PSA	0.3351
PolarSurfaceArea	150.88
Druglikeness	3.0543
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.68571
Fragments	1
Non HAtoms	35
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	1
Symmetricatoms	6
Amides	1
Aromatic Nitrogens	2
StereoCon

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1 - [4-[(Z)-[[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate | 2 - [4-[(Z)-[[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate

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