CAS RN: 22112-78-3

5,10,15,20-Tetrakis(4-methoxyphenyl)porphyrin

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260627 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20250421 250mg In stock Shanghai Inquiry
Batchno.20250922 25g Out of stock Inquiry
Batchno.20251026 5g In stock Shanghai Inquiry
  • Product code: SSC-106375
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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: 5g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 22112-78-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Shanghai Inquiry

22112-78-3 / 5,10,15,20-tetrakis(4-methoxyphenyl)-21,23-dihydroporphyrin

Standard CAS: 22112-78-3 Multi CAS: No

Basic Information

CAS
22112-78-3
Multi CAS
No
Molecular Formula
C48H38N4O4
Molecular Weight
734.800000
Exact Mass
734.289306
SMILES
COC1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)OC)C8=CC=C(C=C8)OC)C=C4)C9=CC=C(C=C9)OC)N3
InChI
InChI=1S/C48H38N4O4/c1-53-33-13-5-29(6-14-33)45-37-21-23-39(49-37)46(30-7-15-34(54-2)16-8-30)41-25-27-43(51-41)48(32-11-19-36(56-4)20-12-32)44-28-26-42(52-44)47(40-24-22-38(45)50-40)31-9-17-35(55-3)18-10-31/h5-28,49,52H,1-4H3
InChIKey
PJOJZHHAECOAFH-UHFFFAOYSA-N

Physical Properties

Physical Description
Purple crystalline powder
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
56
Aromatic heavy atom count
44
Fraction Csp3
0.08
Rotatable bonds
8
H-bond acceptors
6
H-bond donors
2
Molar refractivity
226.81
TPSA
94.28

LogP / Solubility

WLOGP
11.36
MLOGP
10.06
XLogP3
10.3
Consensus LogP
10.57
Log S (ESOL)
-11.61
Class (ESOL)
Insoluble
Log S (Ali)
-13.79
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-14.82
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)
0.86

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
10

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