![CAS 36951-72-1 TMPyP [=α,β,γ,δ-Tetrakis(1-methylpyridinium-4-yl)porphyrin p-Toluenesulfonate] [Ultra-high sensitive spectrophotometric reagent for Cu, Mg] [For the simultaneous determination of metals by HPLC] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/a5014-jpgcontextbwfzdgvyfhjvb3r8mzczmzh8aw1hz2uvanblz3xomdavagfhlzg5mjg1mtizmtezmjyvqtuwmtquanbnfdzlmthmngrhzdbjmmy4mdczmdgzzdfiy2exzjg5yjflotzlmjjkmjiyowm3zdm1nme0odzlzdljnmvhywexyte.jpeg)
CAS RN: 36951-72-1
TMPyP [=α,β,γ,δ-Tetrakis(1-methylpyridinium-4-yl)porphyrin p-Toluenesulfonate] [Ultra-high sensitive spectrophotometric reagent for Cu, Mg] [For the simultaneous determination of metals by HPLC]
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250222 | 1ml | Out of stock | 8-10 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260510 | 100mg | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20250120 | 100mg / 250mg / 1g / 5g | Confirm by inquiry | Shanghai, Guangdong, Chongqing, Shandong | Inquiry | |
| Batchno.20251030 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20260522 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260414 | 50mg | In stock | Shanghai, Wuhan | Inquiry |
- Product code: SSC-144243
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: 0.25g
- 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 |
|---|---|---|---|---|
| 0.25g | ≥98% | 0 Out of Stock | Shanghai | Inquiry |
36951-72-1 / tetrakis(4-methylbenzenesulfonate);5,10,15,20-tetrakis(1-methylpyridin-1-ium-4-yl)-21,22-dihydroporphyrin
Basic Information
CAS
36951-72-1
Multi CAS
Yes
Molecular Formula
C72H66N8O12S4
Molecular Weight
1363.600000
Exact Mass
1362.368304
InChI
InChI=1S/C44H37N8.4C7H8O3S/c1-49-21-13-29(14-22-49)41-33-5-7-35(45-33)42(30-15-23-50(2)24-16-30)37-9-11-39(47-37)44(32-19-27-52(4)28-20-32)40-12-10-38(48-40)43(36-8-6-34(41)46-36)31-17-25-51(3)26-18-31;4*1-6-2-4-7(5-3-6)11(8,9)10/h5-28H,1-4H3,(H,45,46,47,48);4*2-5H,1H3,(H,8,9,10)/q+3;;;;/p-3
InChIKey
AKZFRMNXBLFDNN-UHFFFAOYSA-K
Computed Properties
Structural Parameters
Heavy atom count
96
Aromatic heavy atom count
68
Fraction Csp3
0.11
Rotatable bonds
8
H-bond acceptors
14
H-bond donors
2
Molar refractivity
361.87
TPSA
301.68
LogP / Solubility
WLOGP
10.22
MLOGP
9.13
XLogP3
10.22
Consensus LogP
9.86
Log S (ESOL)
-14.73
Class (ESOL)
Insoluble
Log S (Ali)
-18.12
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-17.96
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.78
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10
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