2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,6-dioxo-3-phenylpyrimidin-4-yl)acetamide

Formula:C19H14N4O4S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,6-dioxo-3-phenylpyrimidin-4-yl)acetamide is a drug-like molecule.

MolName	2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,6-dioxo-3-phenylpyrimidin-4-yl)acetamide
MolecularFormula	C19H14N4O4S
Smiles	O=C(CSc1nc(cccc2)c2o1)NC(N(c1ccccc1)C(N1)=O)=CC1=O
InChI	InChI=1S/C19H14N4O4S/c24-16-10-15(23(18(26)22-16)12-6-2-1-3-7-12)21-17(25)11-28-19-20-13-8-4-5-9-14(13)27-19/h1-10H,11H2,(H,21,25)(H,22,24,26)
InChIK	ALHIAJLVXGDNOM-UHFFFAOYSA-N
TotalMolweight	394.41
Molweight	394.41
MonoisotopicMass	394.073576
CLogP	2.8179
CLogS	-6.326
H Acceptors	8
H Donors	2
TotalSurfaceArea	285
Relative PSA	0.37951
PolarSurfaceArea	129.84
Druglikeness	2.1448
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polar activated DB
Shape Index	0.53571
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	2
Symmetricatoms	2
Amides	3
Aromatic Nitrogens	1
StereoCon

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