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CAS 1092961-01-7 6-Bromomethyl-1-methylindazole molecular structure lightbox
CAS RN: 1092961-01-7

6-Bromomethyl-1-methylindazole

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260313 100mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-010537
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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 1092961-01-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1092961-01-7 / 6-(bromomethyl)-1-methylindazole

6-(BROMOMETHYL)-1-METHYL-1H-INDAZOLE | 6-BROMOMETHYL-1-METHYLINDAZOLE | 6-(bromomethyl)-1-methylindazole

Standard CAS: 1092961-01-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1092961-01-7
Multi CAS
No
Molecular Formula
C9H9BrN2
Molecular Weight
225.080000
Exact Mass
223.994910
SMILES
CN1C2=C(C=CC(=C2)CBr)C=N1
InChI
InChI=1S/C9H9BrN2/c1-12-9-4-7(5-10)2-3-8(9)6-11-12/h2-4,6H,5H2,1H3
InChIKey
PRENRLXOGJUJAG-UHFFFAOYSA-N
Synonyms
6-(BROMOMETHYL)-1-METHYL-1H-INDAZOLE 6-BROMOMETHYL-1-METHYLINDAZOLE 6-(bromomethyl)-1-methylindazole MFCD11052616 6-(Bromomethyl)-1-methyl-indazole

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.22
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
53.35
TPSA
17.82

LogP / Solubility

WLOGP
2.47
MLOGP
2.18
XLogP3
2.7
Consensus LogP
2.45
Log S (ESOL)
-3.28
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.19
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.29
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.34

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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