CAS 323208-61-3 4,4′,4”,4”’-(Porphyrin-5,10,15,20-tetrayl)tetra(benzohydrazide) molecular structure

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CAS RN: 323208-61-3

4,4′,4”,4”’-(Porphyrin-5,10,15,20-tetrayl)tetra(benzohydrazide)

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4 package records1 with current stock2 grade groups

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Batch No.	Package	Availability	Warehouse	Lead Time	Inquiry
Batchno.20260202	50mg / 250mg	Out of stock		15 business days	Inquiry

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Batchno.20250216	100mg	Out of stock		Inquiry
Batchno.20250630	100mg / 250mg / 1g	Confirm by inquiry	Shanghai	Inquiry
Batchno.20260602	250mg	Out of stock		Inquiry

Product code: LINB887440

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323208-61-3 / 4-[10,15,20-tris[4-(hydrazinecarbonyl)phenyl]-21,23-dihydroporphyrin-5-yl]benzohydrazide

Standard CAS: 323208-61-3 Multi CAS: No

Basic Information Computed Properties

Basic Information

CAS

323208-61-3

Multi CAS

Molecular Formula

C48H38N12O4

Molecular Weight

846.900000

Exact Mass

846.313898

InChI

InChI=1S/C48H38N12O4/c49-57-45(61)29-9-1-25(2-10-29)41-33-17-19-35(53-33)42(26-3-11-30(12-4-26)46(62)58-50)37-21-23-39(55-37)44(28-7-15-32(16-8-28)48(64)60-52)40-24-22-38(56-40)43(36-20-18-34(41)54-36)27-5-13-31(14-6-27)47(63)59-51/h1-24,53,56H,49-52H2,(H,57,61)(H,58,62)(H,59,63)(H,60,64)

InChIKey

YSSRVYRNFYLZKY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

247.22

TPSA

277.84

LogP / Solubility

WLOGP

5.74

MLOGP

5.13

XLogP3

4.5

Consensus LogP

5.12

Log S (ESOL)

-8.69

Class (ESOL)

Insoluble

Log S (Ali)

-10.65

Class (Ali)

Insoluble

Log S (SILICOS-IT)

-10.89

Class (SILICOS-IT)

Insoluble

ADME

GI absorption

Low

BBB permeant

P-gp substrate

Yes

CYP1A2 inhibitor

CYP2C19 inhibitor

Yes

CYP2C9 inhibitor

CYP2D6 inhibitor

Yes

CYP3A4 inhibitor

Yes

Log Kp (skin permeation)

-3.81

Drug-likeness / Medicinal Chemistry

Lipinski

Ghose

Veber

Egan

Muegge

Bioavailability score

0.17

Brenk alerts

Leadlikeness

Synthetic Accessibility

4,4′,4”,4”’-(Porphyrin-5,10,15,20-tetrayl)tetra(benzohydrazide)

Product Availability

323208-61-3 / 4-[10,15,20-tris[4-(hydrazinecarbonyl)phenyl]-21,23-dihydroporphyrin-5-yl]benzohydrazide

Basic Information

Computed Properties

Structural Parameters

LogP / Solubility

ADME

Drug-likeness / Medicinal Chemistry

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