N-[(E)-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)amino]thiophene-2-carboxamide

Formula:C15H13N3O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)amino]thiophene-2-carboxamide is a drug-like molecule.

MolName	N-[(E)-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)amino]thiophene-2-carboxamide
MolecularFormula	C15H13N3O2S2
Smiles	O=C(c1cccs1)N/N=C(\N1Cc2ccccc2)/SCC1=O
InChI	InChI=1S/C15H13N3O2S2/c19-13-10-22-15(17-16-14(20)12-7-4-8-21-12)18(13)9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,16,20)
InChIK	XKZQCCUOUIPSHF-UHFFFAOYSA-N
TotalMolweight	331.419
Molweight	331.419
MonoisotopicMass	331.044917
CLogP	2.5223
CLogS	-4.071
H Acceptors	5
H Donors	1
TotalSurfaceArea	240.7
Relative PSA	0.37578
PolarSurfaceArea	115.31
Druglikeness	7.1338
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.59091
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

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