(E)-1-[2-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one

Formula:C20H21N4O3ClS3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-[2-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-[2-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one
MolecularFormula	C20H21N4O3ClS3
Smiles	O=C(/C=C/c1cscc1)N1CCC(CC2)(CN2S(c(n(ccs2)c2n2)c2Cl)(=O)=O)CC1
InChI	InChI=1S/C20H21ClN4O3S3/c21-17-18(25-10-12-30-19(25)22-17)31(27,28)24-9-6-20(14-24)4-7-23(8-5-20)16(26)2-1-15-3-11-29-13-15/h1-3,10-13H,4-9,14H2
InChIK	IYCHSGZRNIXJJP-UHFFFAOYSA-N
TotalMolweight	497.063
Molweight	497.063
MonoisotopicMass	496.046428
CLogP	3.2915
CLogS	-2.022
H Acceptors	7
TotalSurfaceArea	337.49
Relative PSA	0.32108
PolarSurfaceArea	139.85
Druglikeness	5.8843
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54839
Fragments	1
Non HAtoms	31
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	13
Sp3Atoms	9
Symmetricatoms	3
Amides	2
Aromatic Nitrogens	2
StereoCon

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1 - (E)-1-[2-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one | 2 - (E)-1-[2-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one

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