N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide

Formula:C20H20N4O4S3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide is a drug-like molecule.

MolNameN-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide
MolecularFormulaC20H20N4O4S3
SmilesO=C(c(cc1)ccc1NS(c1cccs1)(=O)=O)N/N=C\c1ccc(N2CCOCC2)s1
InChIInChI=1S/C20H20N4O4S3/c25-20(22-21-14-17-7-8-18(30-17)24-9-11-28-12-10-24)15-3-5-16(6-4-15)23-31(26,27)19-2-1-13-29-19/h1-8,13-14,23H,9-12H2,(H,22,25)
InChIKUZBMFOLNERQZSU-UHFFFAOYSA-N
TotalMolweight476.601
Molweight476.601
MonoisotopicMass476.064666
CLogP3.215
CLogS-5.234
H Acceptors8
H Donors2
TotalSurfaceArea340.51
Relative PSA0.38272
PolarSurfaceArea164.96
Druglikeness7.6925
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.64516
Fragments1
Non HAtoms31
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond6
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms16
Sp3Atoms6
Symmetricatoms5
Amides1
StereoCon

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