(5Z)-5-[[2-[2-(2-hydroxyethoxy)ethylamino]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C24H24N4O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[[2-[2-(2-hydroxyethoxy)ethylamino]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-5-[[2-[2-(2-hydroxyethoxy)ethylamino]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C24H24N4O4S2
Smiles	OCCOCCNC(N=C1N2C=CC=C1)=C(/C=C(/C(N1CCc3ccccc3)=O)\SC1=S)C2=O
InChI	InChI=1S/C24H24N4O4S2/c29-13-15-32-14-10-25-21-18(22(30)27-11-5-4-8-20(27)26-21)16-19-23(31)28(24(33)34-19)12-9-17-6-2-1-3-7-17/h1-8,11,16,25,29H,9-10,12-15H2
InChIK	NHIHECOYHPPHHY-UHFFFAOYSA-N
TotalMolweight	496.611
Molweight	496.611
MonoisotopicMass	496.123896
CLogP	0.5001
CLogS	-4.601
H Acceptors	8
H Donors	2
TotalSurfaceArea	373.03
Relative PSA	0.3344
PolarSurfaceArea	151.86
Druglikeness	2.7521
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	polar activated DB
Shape Index	0.55882
Fragments	1
Non HAtoms	34
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	10
Rings Closures	4
Small Rings	4
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	10
Symmetricatoms	2
Amides	2
BasicNitrogens	1
StereoCon

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1 - (5Z)-5-[[2-[2-(2-hydroxyethoxy)ethylamino]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[2-[2-(2-hydroxyethoxy)ethylamino]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

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