(5Z)-3-benzyl-5-[(4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C23H20N4O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-3-benzyl-5-[(4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-3-benzyl-5-[(4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C23H20N4O2S2
Smiles	O=C(/C(/S1)=C/C2=C(N3CCCC3)N=C(C=CC=C3)N3C2=O)N(Cc2ccccc2)C1=S
InChI	InChI=1S/C23H20N4O2S2/c28-21-17(20(25-11-6-7-12-25)24-19-10-4-5-13-26(19)21)14-18-22(29)27(23(30)31-18)15-16-8-2-1-3-9-16/h1-5,8-10,13-14H,6-7,11-12,15H2
InChIK	GXDYGSLVXQIYTB-UHFFFAOYSA-N
TotalMolweight	448.57
Molweight	448.57
MonoisotopicMass	448.102766
CLogP	1.7404
CLogS	-5.099
H Acceptors	6
TotalSurfaceArea	328.26
Relative PSA	0.28554
PolarSurfaceArea	113.61
Druglikeness	5.3368
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polar activated DB
Shape Index	0.48387
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	7
Symmetricatoms	4
Amides	2
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - (5Z)-3-benzyl-5-[(4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-3-benzyl-5-[(4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Request More Details | (5Z)-3-benzyl-5-[(4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments