![CAS 1871-22-3 Blue Tetrazolium [for Biochemical Research] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b3581-jpgcontextbwfzdgvyfhjvb3r8mzy4odj8aw1hz2uvanblz3xozgivagm4lzg5mjg5nzmwotq5ndivqjm1odeuanbnfdviytkxmjhjzmu1mwjinjgwzmnhntblodmyntg2njdhmta1mgeyymjknwjjndu3ztjimzk0mjy1zdqzmtlhmmu.jpeg)
CAS RN: 1871-22-3
Blue Tetrazolium [for Biochemical Research]
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-086944
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: ≥95%
- 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 | ≥95% | 0 Out of Stock | Beijing | Inquiry |
1871-22-3 / 2-[4-[4-(3,5-diphenyltetrazol-2-ium-2-yl)-3-methoxyphenyl]-2-methoxyphenyl]-3,5-diphenyltetrazol-2-ium dichloride
Basic Information
CAS
1871-22-3
Multi CAS
No
Molecular Formula
C40H32Cl2N8O2
Molecular Weight
727.600000
Exact Mass
726.202528
SMILES
COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=CC=C4)C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=CC=C7)C8=CC=CC=C8.[Cl-].[Cl-]
InChI
InChI=1S/C40H32N8O2.2ClH/c1-49-37-27-31(23-25-35(37)47-43-39(29-15-7-3-8-16-29)41-45(47)33-19-11-5-12-20-33)32-24-26-36(38(28-32)50-2)48-44-40(30-17-9-4-10-18-30)42-46(48)34-21-13-6-14-22-34;;/h3-28H,1-2H3;2*1H/q+2;;/p-2
InChIKey
MUUHXGOJWVMBDY-UHFFFAOYSA-L
Computed Properties
Structural Parameters
Heavy atom count
52
Aromatic heavy atom count
46
Fraction Csp3
0.05
Rotatable bonds
9
H-bond acceptors
8
Molar refractivity
188.75
TPSA
87.64
LogP / Solubility
WLOGP
0.43
MLOGP
0.44
XLogP3
0.43
Consensus LogP
0.43
Log S (ESOL)
-4.68
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.84
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.82
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-6.86
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6.5
Safety & Transport
Pictogram(s)
Health Hazard
Signal
Danger
GHS Hazard Statements
H350 (100%): May cause cancer [Danger Carcinogenicity]
Precautionary Statement Codes
P203, P280, P318, P405, and P501
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