N'-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)-N-(2-phenylethyl)butanediamide

Formula:C18H19N5O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)-N-(2-phenylethyl)butanediamide is a drug-like molecule.

MolNameN'-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)-N-(2-phenylethyl)butanediamide
MolecularFormulaC18H19N5O3
SmilesO=C(CCC(Nc(cc1)nc(N2)c1NC2=O)=O)NCCc1ccccc1
InChIInChI=1S/C18H19N5O3/c24-15(19-11-10-12-4-2-1-3-5-12)8-9-16(25)21-14-7-6-13-17(22-14)23-18(26)20-13/h1-7H,8-11H2,(H,19,24)(H3,20,21,22,23,25,26)
InChIKOVGCAUVUNRJGRW-UHFFFAOYSA-N
TotalMolweight353.381
Molweight353.381
MonoisotopicMass353.14879
CLogP1.3913
CLogS-4.597
H Acceptors8
H Donors4
TotalSurfaceArea272.41
Relative PSA0.35215
PolarSurfaceArea112.22
Druglikeness0.76449
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.69231
Fragments1
Non HAtoms26
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond7
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms2
Amides4
Aromatic Nitrogens1
StereoCon

Request More Details | N'-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)-N-(2-phenylethyl)butanediamide


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments