5-N,6-N-bis[(Z)-(4-bromophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

Formula:C18H12N8OBr2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 5-N,6-N-bis[(Z)-(4-bromophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine is not a drug-like molecule.

MolName	5-N,6-N-bis[(Z)-(4-bromophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
MolecularFormula	C18H12N8OBr2
Smiles	Brc1ccc(/C=N\Nc2nc3nonc3nc2N/N=C\c(cc2)ccc2Br)cc1
InChI	InChI=1S/C18H12Br2N8O/c19-13-5-1-11(2-6-13)9-21-25-15-16(24-18-17(23-15)27-29-28-18)26-22-10-12-3-7-14(20)8-4-12/h1-10H,(H,23,25,27)(H,24,26,28)
InChIK	XAQWMNIYNXMRDA-UHFFFAOYSA-N
TotalMolweight	516.156
Molweight	516.156
MonoisotopicMass	513.950079
CLogP	8.6901
CLogS	-7.139
H Acceptors	9
H Donors	2
TotalSurfaceArea	321.81
Relative PSA	0.32295
PolarSurfaceArea	113.48
Druglikeness	1.5875
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.62069
Fragments	1
Non HAtoms	29
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Symmetricatoms	16
Aromatic Nitrogens	4
StereoCon

Click to Load Molecule:

1 - 5-N,6-N-bis[(Z)-(4-bromophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine | 2 - 5-N,6-N-bis[(Z)-(4-bromophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

Request More Details | 5-N,6-N-bis[(Z)-(4-bromophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments