(NE)-N-[4-chloro-3-(3-chloropropyl)-5-formyl-1,3-thiazol-2-ylidene]benzenesulfonamide

Formula:C13H12N2O3Cl2S2 Mutagenic:low Tumorigenic:high Reproductive Effective:high (NE)-N-[4-chloro-3-(3-chloropropyl)-5-formyl-1,3-thiazol-2-ylidene]benzenesulfonamide is a drug-like molecule.

MolName	(NE)-N-[4-chloro-3-(3-chloropropyl)-5-formyl-1,3-thiazol-2-ylidene]benzenesulfonamide
MolecularFormula	C13H12N2O3Cl2S2
Smiles	O=CC(S/C(/N1CCCCl)=N/S(c2ccccc2)(=O)=O)=C1Cl
InChI	InChI=1S/C13H12Cl2N2O3S2/c14-7-4-8-17-12(15)11(9-18)21-13(17)16-22(19,20)10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2
InChIK	LLKYUKDABCWPOE-UHFFFAOYSA-N
TotalMolweight	379.287
Molweight	379.287
MonoisotopicMass	377.966637
CLogP	2.8377
CLogS	-4.287
H Acceptors	5
TotalSurfaceArea	253.68
Relative PSA	0.29238
PolarSurfaceArea	100.49
Druglikeness	-7.5422
Mutagenic	low
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	polar activated DB; 3-halo-enone
Shape Index	0.54545
Fragments	1
Non HAtoms	22
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	5
Symmetricatoms	3
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - (NE)-N-[4-chloro-3-(3-chloropropyl)-5-formyl-1,3-thiazol-2-ylidene]benzenesulfonamide | 2 - (NE)-N-[4-chloro-3-(3-chloropropyl)-5-formyl-1,3-thiazol-2-ylidene]benzenesulfonamide

Request More Details | (NE)-N-[4-chloro-3-(3-chloropropyl)-5-formyl-1,3-thiazol-2-ylidene]benzenesulfonamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments