N-[(Z)-(4-bromophenyl)methylideneamino]-2-[5-(phenylcarbamoylamino)-1,3,4-thiadiazol-2-yl]acetamide

Formula:C18H15N6O2BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(4-bromophenyl)methylideneamino]-2-[5-(phenylcarbamoylamino)-1,3,4-thiadiazol-2-yl]acetamide is a drug-like molecule.

MolName	N-[(Z)-(4-bromophenyl)methylideneamino]-2-[5-(phenylcarbamoylamino)-1,3,4-thiadiazol-2-yl]acetamide
MolecularFormula	C18H15N6O2BrS
Smiles	O=C(Cc1nnc(NC(Nc2ccccc2)=O)s1)N/N=C\c(cc1)ccc1Br
InChI	InChI=1S/C18H15BrN6O2S/c19-13-8-6-12(7-9-13)11-20-23-15(26)10-16-24-25-18(28-16)22-17(27)21-14-4-2-1-3-5-14/h1-9,11H,10H2,(H,23,26)(H2,21,22,25,27)
InChIK	QHUJWRMLUGJVBP-UHFFFAOYSA-N
TotalMolweight	459.327
Molweight	459.327
MonoisotopicMass	458.016055
CLogP	3.9093
CLogS	-5.755
H Acceptors	8
H Donors	3
TotalSurfaceArea	313.27
Relative PSA	0.36477
PolarSurfaceArea	136.61
Druglikeness	4.6642
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.71429
Fragments	1
Non HAtoms	28
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	4
Amides	2
Aromatic Nitrogens	2
StereoCon

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