CAS RN: 1160994-71-7
2-broMopyriMidin-4-aMine
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-016237
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, 25g, 0.25g, 5g, 10g, 100g
- Available purity: >98%
- Inventory rows with stock: 5
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | >98% | 5 In Stock | Hong Kong | Inquiry |
| 25g | >98% | 5 In Stock | Shanghai | Inquiry |
| 0.25g | >98% | 1 In Stock | Beijing | Inquiry |
| 5g | >98% | 1 In Stock | Beijing | Inquiry |
| 10g | >98% | 1 In Stock | Hong Kong | Inquiry |
| 100g | >98% | 0 Out of Stock | Shenzhen | Inquiry |
1160994-71-7 / 2-bromopyrimidin-4-amine
6-bromopyridazin-3-amine | RefChem:541270 | 825-152-2
Basic Information
CAS
1160994-71-7
Multi CAS
Yes
Molecular Formula
C4H4BrN3
Molecular Weight
174.000000
Exact Mass
172.958860
SMILES
C1=CN=C(N=C1N)Br
InChI
InChI=1S/C4H4BrN3/c5-4-7-2-1-3(6)8-4/h1-2H,(H2,6,7,8)
InChIKey
QILIOIATCPZRJQ-UHFFFAOYSA-N
Synonyms
6-bromopyridazin-3-amine
RefChem:541270
825-152-2
3-Amino-6-bromopyridazine
6-BROMO-3-PYRIDAZINAMINE
Computed Properties
Structural Parameters
Heavy atom count
8
Aromatic heavy atom count
6
H-bond acceptors
3
H-bond donors
1
Molar refractivity
34.14
TPSA
51.8
LogP / Solubility
WLOGP
0.82
MLOGP
0.72
XLogP3
0.9
Consensus LogP
0.81
Log S (ESOL)
-1.99
Class (ESOL)
Soluble
Log S (Ali)
-1.58
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.47
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.2
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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