[email protected]
CAS 60146-43-2 TCPP-Fe(2+) molecular structure lightbox
CAS RN: 60146-43-2

TCPP-Fe(2+)

Product Availability

Choose a grade to view its available package options.

4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260126 100mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250519 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20260514 250mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250612 5g Out of stock Inquiry
  • Product code: starshine_CAS60146-43-2
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

60146-43-2 / iron(2+);[4-[10,15,20-tris(4-carboxyphenyl)-23H-porphyrin-5-ylidene]cyclohexa-2,5-dien-1-ylidene]methanediolate

Standard CAS: 60146-43-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
60146-43-2
Multi CAS
Yes
Molecular Formula
C48H28FEN4O8
Molecular Weight
844.600000
Exact Mass
844.125649
InChI
InChI=1S/C48H30N4O8.Fe/c53-45(54)29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(12-4-26)46(55)56)37-21-23-39(51-37)44(28-7-15-32(16-8-28)48(59)60)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(14-6-27)47(57)58;/h1-24H,(H6,49,50,51,52,53,54,55,56,57,58,59,60);/q;+2/p-2
InChIKey
RMKDTEZMQPVWLW-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
61
Aromatic heavy atom count
29
Rotatable bonds
6
H-bond acceptors
8
H-bond donors
4
Molar refractivity
222.19
TPSA
210.89

LogP / Solubility

WLOGP
4.72
MLOGP
4.23
XLogP3
4.72
Consensus LogP
4.56
Log S (ESOL)
-8.01
Class (ESOL)
Insoluble
Log S (Ali)
-9.89
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.79
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-4.52

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10

Customers Also Viewed

Get In Touch

Contact Us