![CAS 872103-27-0 1-Isopropyl-1H-pyrazolo[3,4-b]pyridin-5-aMine;1-(1-Methylethyl)-1H-pyrazolo[3,4-b]pyridin-5-aMine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB5380460.gif)
CAS RN: 872103-27-0
1-Isopropyl-1H-pyrazolo[3,4-b]pyridin-5-aMine;1-(1-Methylethyl)-1H-pyrazolo[3,4-b]pyridin-5-aMine
- Product code: SSC-196925
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
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
872103-27-0 / 1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
Basic Information
CAS
872103-27-0
Multi CAS
No
Molecular Formula
C9H12N4
Molecular Weight
176.220000
Exact Mass
176.106196
InChI
InChI=1S/C9H12N4/c1-6(2)13-9-7(4-12-13)3-8(10)5-11-9/h3-6H,10H2,1-2H3
InChIKey
PMEOZFOGPJEHHE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
52.33
TPSA
56.73
LogP / Solubility
WLOGP
1.59
MLOGP
1.4
XLogP3
0.9
Consensus LogP
1.3
Log S (ESOL)
-2.38
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.16
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.25
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)
-2.66
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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![CAS 872107-76-1 N-[5-(AZEPAN-1-YLSULFONYL)-2-METHOXYPHENYL]-2-CHLOROACETAMIDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB1287503.gif)
