This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
Pack sizes on record: 5g
Available purity: ≥95%
Inventory rows with stock: 0
Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 70359-46-5
Pack Size
Recorded Purity
Available Qty
Ship From
Inquiry
5g
≥95%
0
Out of Stock
Shanghai
Inquiry
70359-46-5 / 5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine;(2R,3R)-2,3-dihydroxybutanedioic acid
Standard CAS: 70359-46-5
Multi CAS: Yes
Basic Information
copy
CAS
70359-46-5 copy
Multi CAS
Yes copy
Molecular Formula
BC15H16O6Rn5 copy
Molecular Weight
442.220000 copy
Exact Mass
441.028400 copy
InChI
InChI=1S/C11H10BrN5.C4H6O6/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8;5-1(3(7)8)2(6)4(9)10/h1-4H,5-6H2,(H2,15,16,17);1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1 copy
InChIKey
QZHBYNSSDLTCRG-LREBCSMRSA-N copy
Computed Properties
copy
Structural Parameters
Heavy atom count
27 copy
Aromatic heavy atom count
10 copy
Fraction Csp3
0.27 copy
Rotatable bonds
4 copy
H-bond acceptors
9 copy
H-bond donors
6 copy
Molar refractivity
98.45 copy
TPSA
177.26 copy
LogP / Solubility
WLOGP
-0.36 copy
MLOGP
-0.29 copy
XLogP3
-0.36 copy
Consensus LogP
-0.34 copy
Log S (ESOL)
-2.37 copy
Class (ESOL)
Moderately soluble copy
Log S (Ali)
-2.93 copy
Class (Ali)
Moderately soluble copy
Log S (SILICOS-IT)
-2.72 copy
Class (SILICOS-IT)
Moderately soluble copy
ADME
GI absorption
Low copy
BBB permeant
No copy
P-gp substrate
Yes copy
CYP1A2 inhibitor
No copy
CYP2C19 inhibitor
No copy
CYP2C9 inhibitor
No copy
CYP2D6 inhibitor
No copy
CYP3A4 inhibitor
No copy
Log Kp (skin permeation)
-5.67 copy
Drug-likeness / Medicinal Chemistry
Lipinski
Yes copy
Ghose
Yes copy
Veber
No copy
Egan
No copy
Muegge
No copy
Bioavailability score
0.55 copy
Leadlikeness
No copy
Synthetic Accessibility
3.5 copy