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CAS 22112-89-6 5,15-Diphenylporphyrin molecular structure lightbox
CAS RN: 22112-89-6

5,15-Diphenylporphyrin

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250225 100mg In stock Shanghai Inquiry
Batchno.20260506 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20251024 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20251201 5mg / 10mg / 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-106383
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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: 0.25g
  • Available purity: ≥95%
  • 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 22112-89-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

22112-89-6 / 10,20-diphenyl-21,22-dihydroporphyrin

Standard CAS: 22112-89-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22112-89-6
Multi CAS
No
Molecular Formula
C32H22N4
Molecular Weight
462.500000
Exact Mass
462.184447
SMILES
C1=CC=C(C=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=N5)C=C6C=CC2=N6)C7=CC=CC=C7)N3
InChI
InChI=1S/C32H22N4/c1-3-7-21(8-4-1)31-27-15-11-23(33-27)19-25-13-17-29(35-25)32(22-9-5-2-6-10-22)30-18-14-26(36-30)20-24-12-16-28(31)34-24/h1-20,33,35H
InChIKey
QIBKIAFNCVIIMG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
36
Aromatic heavy atom count
32
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
149.73
TPSA
57.36

LogP / Solubility

WLOGP
7.99
MLOGP
7.06
XLogP3
7.2
Consensus LogP
7.42
Log S (ESOL)
-8.27
Class (ESOL)
Insoluble
Log S (Ali)
-9.12
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.54
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
10

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