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CAS 87345-22-0 5,10,15-triphenyl-20-(4-hydroxyphenyl)-21H,23H-porphyrin molecular structure lightbox
CAS RN: 87345-22-0

5,10,15-triphenyl-20-(4-hydroxyphenyl)-21H,23H-porphyrin

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8 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260207 100mg In stock Inquiry
Batchno.20251130 1g In stock Inquiry
Batchno.20250511 250mg In stock Inquiry
Batchno.20251101 25mg Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251004 100mg In stock Shanghai Inquiry
Batchno.20260520 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20250104 250mg In stock Shanghai Inquiry
Batchno.20260211 50mg In stock Shanghai Inquiry
  • Product code: starshine_CAS87345-22-0
  • Purity/Analytical Methods: >99.0%
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87345-22-0 / 4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)phenol

Standard CAS: 87345-22-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
87345-22-0
Multi CAS
Yes
Molecular Formula
C44H30N4O
Molecular Weight
630.700000
Exact Mass
630.241962
InChI
InChI=1S/C44H30N4O/c49-32-18-16-31(17-19-32)44-39-26-24-37(47-39)42(29-12-6-2-7-13-29)35-22-20-33(45-35)41(28-10-4-1-5-11-28)34-21-23-36(46-34)43(30-14-8-3-9-15-30)38-25-27-40(44)48-38/h1-27,45,48-49H
InChIKey
QMONKZRPMBDZDY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
49
Aromatic heavy atom count
44
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
3
Molar refractivity
202.27
TPSA
77.59

LogP / Solubility

WLOGP
11.03
MLOGP
9.76
XLogP3
10.1
Consensus LogP
10.3
Log S (ESOL)
-11.1
Class (ESOL)
Insoluble
Log S (Ali)
-12.7
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-13.39
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
1.26

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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