2,4-dichloro-N-[(Z)-[5-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanylfuran-2-yl]methylideneamino]benzamide

Formula:C24H17N3O3Cl2S Mutagenic:high Tumorigenic:high Reproductive Effective:none 2,4-dichloro-N-[(Z)-[5-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanylfuran-2-yl]methylideneamino]benzamide is not a drug-like molecule.

MolName	2,4-dichloro-N-[(Z)-[5-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanylfuran-2-yl]methylideneamino]benzamide
MolecularFormula	C24H17N3O3Cl2S
Smiles	O=C(CSc1ccc(/C=N\NC(c(ccc(Cl)c2)c2Cl)=O)o1)Nc1cc2ccccc2cc1
InChI	InChI=1S/C24H17Cl2N3O3S/c25-17-6-9-20(21(26)12-17)24(31)29-27-13-19-8-10-23(32-19)33-14-22(30)28-18-7-5-15-3-1-2-4-16(15)11-18/h1-13H,14H2,(H,28,30)(H,29,31)
InChIK	VKSYMBKFMIMYGR-UHFFFAOYSA-N
TotalMolweight	498.389
Molweight	498.389
MonoisotopicMass	497.036766
CLogP	6.2544
CLogS	-8.298
H Acceptors	6
H Donors	2
TotalSurfaceArea	362.34
Relative PSA	0.25421
PolarSurfaceArea	109
Druglikeness	7.2592
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	33
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Amides	1
StereoCon

Click to Load Molecule:

1 - 2,4-dichloro-N-[(Z)-[5-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanylfuran-2-yl]methylideneamino]benzamide | 2 - 2,4-dichloro-N-[(Z)-[5-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanylfuran-2-yl]methylideneamino]benzamide

Request More Details | 2,4-dichloro-N-[(Z)-[5-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanylfuran-2-yl]methylideneamino]benzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments