N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-4-piperidin-1-ylsulfonylbenzamide

Formula:C24H25N3O5S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-4-piperidin-1-ylsulfonylbenzamide is a drug-like molecule.

MolName	N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-4-piperidin-1-ylsulfonylbenzamide
MolecularFormula	C24H25N3O5S2
Smiles	O=C(c(cc1)ccc1S(N1CCCCC1)(=O)=O)NCCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O
InChI	InChI=1S/C24H25N3O5S2/c28-22(19-9-11-20(12-10-19)34(31,32)26-14-5-2-6-15-26)25-13-16-27-23(29)21(33-24(27)30)17-18-7-3-1-4-8-18/h1,3-4,7-12,17H,2,5-6,13-16H2,(H,25,28)
InChIK	ODCTVHJPYWYOGI-UHFFFAOYSA-N
TotalMolweight	499.611
Molweight	499.611
MonoisotopicMass	499.123562
CLogP	2.8829
CLogS	-4.119
H Acceptors	8
H Donors	1
TotalSurfaceArea	358.43
Relative PSA	0.28946
PolarSurfaceArea	137.54
Druglikeness	4.0912
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	9
Symmetricatoms	7
Amides	3
StereoCon

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