4-[4-[(4-chlorophenoxy)methyl]piperazin-1-yl]-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide

Formula:C21H23N6O4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[4-[(4-chlorophenoxy)methyl]piperazin-1-yl]-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide is a drug-like molecule.

MolName	4-[4-[(4-chlorophenoxy)methyl]piperazin-1-yl]-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide
MolecularFormula	C21H23N6O4Cl
Smiles	O=C(CCC(N1CCN(COc(cc2)ccc2Cl)CC1)=O)Nc(cc1)nc(N2)c1NC2=O
InChI	InChI=1S/C21H23ClN6O4/c22-14-1-3-15(4-2-14)32-13-27-9-11-28(12-10-27)19(30)8-7-18(29)24-17-6-5-16-20(25-17)26-21(31)23-16/h1-6H,7-13H2,(H3,23,24,25,26,29,31)
InChIK	GMBBAYNKQSHFBT-UHFFFAOYSA-N
TotalMolweight	458.905
Molweight	458.905
MonoisotopicMass	458.146931
CLogP	1.9384
CLogS	-4.884
H Acceptors	10
H Donors	3
TotalSurfaceArea	334.75
Relative PSA	0.30342
PolarSurfaceArea	115.9
Druglikeness	5.9649
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6875
Fragments	1
Non HAtoms	32
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	9
Symmetricatoms	4
Amides	4
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - 4-[4-[(4-chlorophenoxy)methyl]piperazin-1-yl]-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide | 2 - 4-[4-[(4-chlorophenoxy)methyl]piperazin-1-yl]-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide

Request More Details | 4-[4-[(4-chlorophenoxy)methyl]piperazin-1-yl]-4-oxo-N-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)butanamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments