![CAS 4386-25-8 Lumogallion [Fluorimetric reagent for Al, Ga and other metals] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/a5060-jpgcontextbwfzdgvyfhjvb3r8mzazmjf8aw1hz2uvanblz3xoyjevadlilzg5mjg1mti3nzawnzgvqtuwnjauanbnfdu1y2zjntmxnjyynmvmymi3zjc1mjvlotlizjjkzwrknjbimzvlmtmzodawmdnhotiyzjdlm2q5m2e4nte3ytg.jpeg)
CAS RN: 4386-25-8
Lumogallion [Fluorimetric reagent for Al, Ga and other metals]
- Product code: SSC-151939
Historical Factory Record
Historical Supply Reference
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: 1g
- Available purity: ≥98%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
4386-25-8 / 5-chloro-3-[(2,4-dihydroxyphenyl)diazenyl]-2-hydroxybenzenesulfonic acid
Basic Information
CAS
4386-25-8
Multi CAS
Yes
Molecular Formula
C12H9CLN2O6S
Molecular Weight
344.730000
Exact Mass
343.986985
InChI
InChI=1S/C12H9ClN2O6S/c13-6-3-9(12(18)11(4-6)22(19,20)21)15-14-8-2-1-7(16)5-10(8)17/h1-5,16-18H,(H,19,20,21)
InChIKey
OTKYOGBGHUUFPC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
12
Rotatable bonds
3
H-bond acceptors
7
H-bond donors
4
Molar refractivity
76.88
TPSA
139.78
LogP / Solubility
WLOGP
3.12
MLOGP
2.76
XLogP3
2.6
Consensus LogP
2.83
Log S (ESOL)
-4.15
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.64
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.85
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.61
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
No
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
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