5-nitro-6-[(E)-2-(2-phenylmethoxynaphthalen-1-yl)ethenyl]-1H-pyrimidine-2,4-dione

Formula:C23H17N3O5 Mutagenic:high Tumorigenic:high Reproductive Effective:none 5-nitro-6-[(E)-2-(2-phenylmethoxynaphthalen-1-yl)ethenyl]-1H-pyrimidine-2,4-dione is a drug-like molecule.

MolName	5-nitro-6-[(E)-2-(2-phenylmethoxynaphthalen-1-yl)ethenyl]-1H-pyrimidine-2,4-dione
MolecularFormula	C23H17N3O5
Smiles	[O-][N+](C(C(N1)=O)=C(/C=C/c(c2ccccc2cc2)c2OCc2ccccc2)NC1=O)=O
InChI	InChI=1S/C23H17N3O5/c27-22-21(26(29)30)19(24-23(28)25-22)12-11-18-17-9-5-4-8-16(17)10-13-20(18)31-14-15-6-2-1-3-7-15/h1-13H,14H2,(H2,24,25,27,28)
InChIK	WRJXZZWTIBRSQV-UHFFFAOYSA-N
TotalMolweight	415.404
Molweight	415.404
MonoisotopicMass	415.116822
CLogP	2.8385
CLogS	-6.353
H Acceptors	8
H Donors	2
TotalSurfaceArea	309.39
Relative PSA	0.28902
PolarSurfaceArea	113.25
Druglikeness	-3.006
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.45161
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	3
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - 5-nitro-6-[(E)-2-(2-phenylmethoxynaphthalen-1-yl)ethenyl]-1H-pyrimidine-2,4-dione | 2 - 5-nitro-6-[(E)-2-(2-phenylmethoxynaphthalen-1-yl)ethenyl]-1H-pyrimidine-2,4-dione

Request More Details | 5-nitro-6-[(E)-2-(2-phenylmethoxynaphthalen-1-yl)ethenyl]-1H-pyrimidine-2,4-dione

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments