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CAS 1214899-85-0 6-bromo-1-methyl-1H-indazol-3-amine molecular structure lightbox
CAS RN: 1214899-85-0

6-bromo-1-methyl-1H-indazol-3-amine

  • Product code: SSC-023955
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 25g, 100g, 0.25g, 1000g
  • Available purity: ≥97%
  • Inventory rows with stock: 12
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1214899-85-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 5 In Stock Shenzhen Inquiry
1g ≥97% 5 In Stock Shenzhen Inquiry
5g -- 5 In Stock Shenzhen Inquiry
5g ≥97% 5 In Stock Hong Kong Inquiry
10g -- 5 In Stock Shanghai Inquiry
10g ≥97% 5 In Stock Hong Kong Inquiry
25g -- 5 In Stock Shenzhen Inquiry
25g ≥97% 5 In Stock Hong Kong Inquiry
100g -- 5 In Stock Shenzhen Inquiry
100g ≥97% 5 In Stock Beijing Inquiry
0.25g -- 3 In Stock Hong Kong Inquiry
0.25g ≥97% 3 In Stock Shenzhen Inquiry
1000g -- 0 Out of Stock Shanghai Inquiry

1214899-85-0 / 6-bromo-1-methylindazol-3-amine

Standard CAS: 1214899-85-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1214899-85-0
Multi CAS
No
Molecular Formula
C8H8BrN3
Molecular Weight
226.070000
Exact Mass
224.990160
SMILES
CN1C2=C(C=CC(=C2)Br)C(=N1)N
InChI
InChI=1S/C8H8BrN3/c1-12-7-4-5(9)2-3-6(7)8(10)11-12/h2-4H,1H3,(H2,10,11)
InChIKey
SJCNMXPRXAGVMK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.12
H-bond acceptors
3
H-bond donors
1
Molar refractivity
52.83
TPSA
43.84

LogP / Solubility

WLOGP
1.92
MLOGP
1.69
XLogP3
1.9
Consensus LogP
1.84
Log S (ESOL)
-3.01
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.8
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.72
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.74

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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