(2S)-2-[5-(4-ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-phenylpropanamide

Formula:C23H21N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:high (2S)-2-[5-(4-ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-phenylpropanamide is a drug-like molecule.

MolName	(2S)-2-[5-(4-ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-phenylpropanamide
MolecularFormula	C23H21N3O3S
Smiles	CCOc(cc1)ccc1-c1csc(N=CN2[C@@H](C)C(Nc3ccccc3)=O)c1C2=O
InChI	InChI=1S/C23H21N3O3S/c1-3-29-18-11-9-16(10-12-18)19-13-30-22-20(19)23(28)26(14-24-22)15(2)21(27)25-17-7-5-4-6-8-17/h4-15H,3H2,1-2H3,(H,25,27)/t15-/m0/s1
InChIK	XQLPBWJQDWDVMN-HNNXBMFYSA-N
TotalMolweight	419.504
Molweight	419.504
MonoisotopicMass	419.130362
CLogP	3.9351
CLogS	-5.948
H Acceptors	6
H Donors	1
TotalSurfaceArea	318.02
Relative PSA	0.26086
PolarSurfaceArea	99.24
Druglikeness	4.5734
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	4
Amides	2
StereoCon	this enantiomer

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