CAS RN: 38800-20-3
2,3-Diphenyl-5-(2-thienyl)tetrazolium Chloride
- Product code: SSC-146421
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 | Hong Kong | Inquiry |
38800-20-3 / 2,3-diphenyl-5-thiophen-2-yltetrazol-2-ium chloride
Basic Information
CAS
38800-20-3
Multi CAS
Yes
Molecular Formula
C17H13CLN4S
Molecular Weight
340.800000
Exact Mass
340.054945
InChI
InChI=1S/C17H13N4S.ClH/c1-3-8-14(9-4-1)20-18-17(16-12-7-13-22-16)19-21(20)15-10-5-2-6-11-15;/h1-13H;1H/q+1;/p-1
InChIKey
RLHVMOZOYHDIGV-UHFFFAOYSA-M
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
22
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
86.2
TPSA
34.59
LogP / Solubility
WLOGP
0.28
MLOGP
0.26
XLogP3
0.28
Consensus LogP
0.27
Log S (ESOL)
-2.64
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.55
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.6
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3
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2,3-Bis(4-methoxyphenyl)-5-phenyltetrazolium Chloride
- CAS RN: 104497-79-2
- Product Code: SSC-006306
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