CAS 885519-16-4 3-BROMO-5-IODO (1H)INDAZOLE molecular structure

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CAS RN: 885519-16-4

3-BROMO-5-IODO (1H)INDAZOLE

Product Availability

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1 package records0 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Lead Time	Inquiry
Batchno.20250502	250mg / 1g / 5g	Out of stock	8-10 business days	Inquiry

Product code: SSC-199531

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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: 1g
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 885519-16-4
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	＞95%	0 Out of Stock	Shanghai	Inquiry

885519-16-4 / 3-bromo-5-iodo-2H-indazole

Standard CAS: 885519-16-4 Multi CAS: No

Basic Information Computed Properties

Basic Information

CAS

885519-16-4

Multi CAS

Molecular Formula

C7H4BRIN2

Molecular Weight

322.930000

Exact Mass

321.860260

InChI

InChI=1S/C7H4BrIN2/c8-7-5-3-4(9)1-2-6(5)10-11-7/h1-3H,(H,10,11)

InChIKey

WAQOXWKMCDTDEP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

H-bond acceptors

H-bond donors

Molar refractivity

56.51

TPSA

28.68

LogP / Solubility

WLOGP

2.93

MLOGP

2.59

XLogP3

3.2

Consensus LogP

2.91

Log S (ESOL)

-4.29

Class (ESOL)

Slightly soluble

Log S (Ali)

-4.32

Class (Ali)

Slightly soluble

Log S (SILICOS-IT)

-4.19

Class (SILICOS-IT)

Slightly soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

Yes

CYP2C19 inhibitor

Yes

CYP2C9 inhibitor

Yes

CYP2D6 inhibitor

CYP3A4 inhibitor

Log Kp (skin permeation)

-2.61

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Yes

Synthetic Accessibility

1.5

3-BROMO-5-IODO (1H)INDAZOLE

Product Availability

Historical Supply Reference

Reference Pack Sizes

885519-16-4 / 3-bromo-5-iodo-2H-indazole

Basic Information

Computed Properties

Structural Parameters

LogP / Solubility

ADME

Drug-likeness / Medicinal Chemistry

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