RefChem:1063185

7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-[(2E)-2-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]hydrazinyl]purine-2,6-dione

Also Known As: 2-Furanacrolein, 5-nitro-, (7-(2,3-dihydroxypropyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-8-yl)hydrazone|5-Nitro-2-furanacrylaldehyde [7-(2,3-dihydroxypropyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-8-yl]hydrazone|7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-[(2E)-2-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]hydrazinyl]purine-2,6-dione|7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-{2-[3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene]hydrazin-1-yl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione

Molecular Formula	C17H19N7O7
Molecular Weight	433.13458 g/mol
LogP	-0.6008
Topological Polar Surface Area	182.95 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	10
Rotatable Bonds	8
Exact Mass	433.13458
Monoisotopic Mass	433.13458
Heavy Atoms	31
Complexity	1294.612

Chemical Identifiers

CAS Number	78960-59-5
SMILES	CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N/N=C/C=C/C3=CC=C(O3)[N+](=O)[O-])CC(CO)O