Mitoguazone dihydrochlorideProduct ingredient for Mitoguazone

Name
Mitoguazone dihydrochloride
Drug Entry
Mitoguazone

Mitoguazone has been used in trials studying the treatment of Lymphoma, HIV Infections, and Lymphoma, Non-Hodgkin.

Accession Number
DBSALT002907
Structure
Synonyms
Mitoguazone HCl / Mitoguazone hydrochloride
UNII
NNI098FX5Q
CAS Number
7059-23-6
Weight
Average: 257.12
Monoisotopic: 256.0718479
Chemical Formula
C5H14Cl2N8
InChI Key
VVTBQCXLZQYGQE-PVTAQEPXSA-N
InChI
InChI=1S/C5H12N8.2ClH/c1-3(11-13-5(8)9)2-10-12-4(6)7;;/h2H,1H3,(H4,6,7,12)(H4,8,9,13);2*1H/b10-2+,11-3+;;
IUPAC Name
N''-[(E)-[(1E)-1-{[(diaminomethylidene)amino]imino}propan-2-ylidene]amino]guanidine dihydrochloride
SMILES
Cl.Cl.C\C(\C=N\N=C(N)N)=N/N=C(N)N
ChemSpider
7844720
ChEBI
78028
Predicted Properties
PropertyValueSource
Water Solubility0.412 mg/mLALOGPS
logP0.93ALOGPS
logP-2.2Chemaxon
logS-2.6ALOGPS
pKa (Strongest Acidic)16.46Chemaxon
pKa (Strongest Basic)7.38Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count8Chemaxon
Hydrogen Donor Count4Chemaxon
Polar Surface Area153.52 Å2Chemaxon
Rotatable Bond Count3Chemaxon
Refractivity48.85 m3·mol-1Chemaxon
Polarizability18.58 Å3Chemaxon
Number of Rings0Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon