![CAS 2443816-45-1 2-Thiophenecarboxamide, N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-[6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2443816-45-1.gif)
CAS RN: 2443816-45-1
2-Thiophenecarboxamide, N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-[6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]-
Product Availability
Choose a grade to view its available package options.
11 package records9 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260207 | 5mg / 10mg | Confirm by inquiry | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250608 | 100mg | Out of stock | Inquiry | |
| Batchno.20251219 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250820 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260330 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260127 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250706 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS2443816-45-1
- Purity/Analytical Methods: >99.0%
2443816-45-1 / N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-[6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]thiophene-2-carboxamide
Basic Information
CAS
2443816-45-1
Multi CAS
No
Molecular Formula
C22H16F4N4OS
Molecular Weight
460.400000
Exact Mass
460.098095
SMILES
C1CC1[C@@H](C(F)(F)F)NC(=O)C2=CC(=CS2)C3=C4N=CC(=CN4N=C3)C5=CC=C(C=C5)F
InChI
InChI=1S/C22H16F4N4OS/c23-16-5-3-12(4-6-16)15-8-27-20-17(9-28-30(20)10-15)14-7-18(32-11-14)21(31)29-19(13-1-2-13)22(24,25)26/h3-11,13,19H,1-2H2,(H,29,31)/t19-/m0/s1
InChIKey
PFZRXJIYAFANHP-IBGZPJMESA-N
Computed Properties
Structural Parameters
Heavy atom count
32
Aromatic heavy atom count
20
Fraction Csp3
0.23
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
1
Molar refractivity
111.73
TPSA
59.29
LogP / Solubility
WLOGP
5.33
MLOGP
4.73
XLogP3
4.9
Consensus LogP
4.99
Log S (ESOL)
-6.19
Class (ESOL)
Insoluble
Log S (Ali)
-7.19
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.68
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.74
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4
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