![CAS 2097133-17-8 (1S)-1-[6-(4-fluoropyrazol-1-yl)-3-pyridyl]ethanamine hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2097133-17-8.png)
CAS RN: 2097133-17-8
(1S)-1-[6-(4-fluoropyrazol-1-yl)-3-pyridyl]ethanamine hydrochloride
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260104 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: SSC-099505
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 |
2097133-17-8 / (1S)-1-[6-(4-fluoropyrazol-1-yl)-3-pyridinyl]ethanamine;hydrochloride
Basic Information
CAS
2097133-17-8
Multi CAS
No
Molecular Formula
C10H12ClFN4
Molecular Weight
242.680000
Exact Mass
242.073452
SMILES
C[C@@H](C1=CN=C(C=C1)N2C=C(C=N2)F)N.Cl
InChI
InChI=1S/C10H11FN4.ClH/c1-7(12)8-2-3-10(13-4-8)15-6-9(11)5-14-15;/h2-7H,12H2,1H3;1H/t7-;/m0./s1
InChIKey
KSTUXVLXCHWSGC-FJXQXJEOSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
11
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
61.17
TPSA
56.73
LogP / Solubility
WLOGP
1.85
MLOGP
1.63
XLogP3
1.85
Consensus LogP
1.78
Log S (ESOL)
-2.89
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.88
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.01
Class (SILICOS-IT)
Poorly 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)
-2.89
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
Cyclohexanecarboxylic acid, 4-iodo-1-methoxy-, methyl ester
- CAS RN: 2097133-18-9
- Product Code: SSC-099506
-
Cyclohexanecarboxylic acid, 4-(1,6-dihydro-4-methyl-6-oxo-2-pyrimidinyl)-1-methoxy-, methyl ester
- CAS RN: 2097133-30-5
- Product Code: SSC-099507
-
Cyclohexanecarboxylic acid, 4-(4-chloro-6-methyl-2-pyrimidinyl)-1-methoxy-, methyl ester
- CAS RN: 2097133-31-6
- Product Code: SSC-099508
-
methyl 8-methoxy-1,4-dioxaspiro[4.5]decane-8-carboxylate
- CAS RN: 2097133-36-1
- Product Code: SSC-099509
-
(S)-3′-hydroxy Blebbistatin
- CAS RN: 2097136-42-8
- Product Code: starshine_CAS2097136-42-8
- Purity/Analytical method: >99.0%
-
![CAS 2097133-36-1 methyl 8-methoxy-1,4-dioxaspiro[4.5]decane-8-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2097133-36-1.png)
