N'-[(Z)-[2-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)oxamide

Formula:C24H18N5O3BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[(Z)-[2-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)oxamide is not a drug-like molecule.

MolNameN'-[(Z)-[2-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)oxamide
MolecularFormulaC24H18N5O3BrS
SmilesO=C(C(N/N=C\c(cccc1)c1OCc(cc1)ccc1Br)=O)Nc1nnc(-c2ccccc2)s1
InChIInChI=1S/C24H18BrN5O3S/c25-19-12-10-16(11-13-19)15-33-20-9-5-4-8-18(20)14-26-28-22(32)21(31)27-24-30-29-23(34-24)17-6-2-1-3-7-17/h1-14H,15H2,(H,28,32)(H,27,30,31)
InChIKHGEBMPJBVJXFTD-UHFFFAOYSA-N
TotalMolweight536.409
Molweight536.409
MonoisotopicMass535.031371
CLogP4.8852
CLogS-6.204
H Acceptors8
H Donors2
TotalSurfaceArea371.57
Relative PSA0.3036
PolarSurfaceArea133.81
Druglikeness3.043
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index0.64706
Fragments1
Non HAtoms34
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond8
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms23
Sp3Atoms2
Symmetricatoms4
Amides1
Aromatic Nitrogens2
StereoCon

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