CAS RN: 34294-67-2
Dibenzo[b,e][1,4]dioxin-2,3,7,8-tetramine
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250108 |
100mg / 250mg / 1g |
Out of stock |
8-10 business days | Inquiry |
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Product code:
starshine_CAS34294-67-2
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Purity/Analytical Methods:
>99.0%
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34294-67-2 / dibenzo-p-dioxin-2,3,7,8-tetramine
Standard CAS: 34294-67-2
Multi CAS: No
Basic Information
CAS
34294-67-2
Multi CAS
No
Molecular Formula
C12H12N4O2
Molecular Weight
244.250000
Exact Mass
244.096026
InChI
InChI=1S/C12H12N4O2/c13-5-1-9-10(2-6(5)14)18-12-4-8(16)7(15)3-11(12)17-9/h1-4H,13-16H2
InChIKey
SCNPGKBZQYWAPN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
12
H-bond acceptors
6
H-bond donors
4
Molar refractivity
70.68
TPSA
122.54
LogP / Solubility
WLOGP
1.91
MLOGP
1.69
XLogP3
1.2
Consensus LogP
1.6
Log S (ESOL)
-3.05
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.94
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.84
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5