1-[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-naphthalen-1-ylthiourea

Formula:C24H19N3O2S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none 1-[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-naphthalen-1-ylthiourea is not a drug-like molecule.

MolName	1-[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-naphthalen-1-ylthiourea
MolecularFormula	C24H19N3O2S2
Smiles	O=S(c1ccccc1)(/N=C(\c1ccccc1)/NC(Nc1cccc2ccccc12)=S)=O
InChI	InChI=1S/C24H19N3O2S2/c28-31(29,20-14-5-2-6-15-20)27-23(19-11-3-1-4-12-19)26-24(30)25-22-17-9-13-18-10-7-8-16-21(18)22/h1-17H,(H2,25,26,27,30)
InChIK	VHRQWJBTIVLRRD-UHFFFAOYSA-N
TotalMolweight	445.566
Molweight	445.566
MonoisotopicMass	445.091867
CLogP	5.3865
CLogS	-6.371
H Acceptors	5
H Donors	2
TotalSurfaceArea	334.56
Relative PSA	0.27203
PolarSurfaceArea	111.03
Druglikeness	-5.9428
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.48387
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
Symmetricatoms	5
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - 1-[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-naphthalen-1-ylthiourea | 2 - 1-[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-naphthalen-1-ylthiourea

Request More Details | 1-[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-naphthalen-1-ylthiourea

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments