2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-quinolin-8-ylmethylideneamino]acetamide

Formula:C26H20N6OS Mutagenic:none Tumorigenic:high Reproductive Effective:none 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-quinolin-8-ylmethylideneamino]acetamide is a drug-like molecule.

MolName	2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-quinolin-8-ylmethylideneamino]acetamide
MolecularFormula	C26H20N6OS
Smiles	O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)N/N=C\c1cccc2cccnc12
InChI	InChI=1S/C26H20N6OS/c33-23(29-28-17-21-12-7-11-19-13-8-16-27-24(19)21)18-34-26-31-30-25(20-9-3-1-4-10-20)32(26)22-14-5-2-6-15-22/h1-17H,18H2,(H,29,33)
InChIK	YUVFEKYBTHSRLB-UHFFFAOYSA-N
TotalMolweight	464.552
Molweight	464.552
MonoisotopicMass	464.141929
CLogP	4.8478
CLogS	-9.122
H Acceptors	7
H Donors	1
TotalSurfaceArea	357.84
Relative PSA	0.26068
PolarSurfaceArea	110.36
Druglikeness	5.4255
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.52941
Fragments	1
Non HAtoms	34
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	27
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	4
StereoCon

Click to Load Molecule:

1 - 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-quinolin-8-ylmethylideneamino]acetamide | 2 - 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-quinolin-8-ylmethylideneamino]acetamide

Request More Details | 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-quinolin-8-ylmethylideneamino]acetamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments