N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide

Formula:C25H23N5O4S3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide is not a drug-like molecule.

MolName	N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide
MolecularFormula	C25H23N5O4S3
Smiles	O=C(c(cc1)ccc1NS(c1cccs1)(=O)=O)N/N=C\c1c(-c2ccccc2)nc(N2CCOCC2)s1
InChI	InChI=1S/C25H23N5O4S3/c31-24(19-8-10-20(11-9-19)29-37(32,33)22-7-4-16-35-22)28-26-17-21-23(18-5-2-1-3-6-18)27-25(36-21)30-12-14-34-15-13-30/h1-11,16-17,29H,12-15H2,(H,28,31)
InChIK	PVALGLZGAHHWHT-UHFFFAOYSA-N
TotalMolweight	553.687
Molweight	553.687
MonoisotopicMass	553.091215
CLogP	4.6165
CLogS	-6.695
H Acceptors	9
H Donors	2
TotalSurfaceArea	399.03
Relative PSA	0.35408
PolarSurfaceArea	177.85
Druglikeness	7.8102
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.54054
Fragments	1
Non HAtoms	37
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	6
Symmetricatoms	7
Amides	1
Aromatic Nitrogens	1
StereoCon

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