CAS RN: 70476-82-3
Mitoxantrone Dihydrochloride
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250829 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250701 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20250325 | 1mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20251228 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260512 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260413 | 5g | Out of stock | Inquiry |
- Product code: ICTM3110
- Purity/Analytical Methods: >97.0%(HPLC)
70476-82-3 / 1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione;dihydrochloride
Basic Information
CAS
70476-82-3
Multi CAS
Yes
Molecular Formula
C22H30CL2N4O6
Molecular Weight
517.400000
Exact Mass
516.154240
InChI
InChI=1S/C22H28N4O6.2ClH/c27-11-9-23-5-7-25-13-1-2-14(26-8-6-24-10-12-28)18-17(13)21(31)19-15(29)3-4-16(30)20(19)22(18)32;;/h1-4,23-30H,5-12H2;2*1H
InChIKey
ZAHQPTJLOCWVPG-UHFFFAOYSA-N
Physical Properties
Melting Point
203-5 °C
Physical Description
Crystals; [Merck Index]
Appearance
Blue-black solid from water ethanol
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
34
Aromatic heavy atom count
12
Fraction Csp3
0.36
Rotatable bonds
12
H-bond acceptors
10
H-bond donors
8
Molar refractivity
134.47
TPSA
163.18
LogP / Solubility
WLOGP
0.7
MLOGP
0.66
XLogP3
0.7
Consensus LogP
0.69
Log S (ESOL)
-2.96
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.05
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.38
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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