![CAS 870235-46-4 4-Fluorothieno[2,3-c]pyridine-2-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/870235-46-4.png)
CAS RN: 870235-46-4
4-Fluorothieno[2,3-c]pyridine-2-carboxylic acid
Product Availability
Choose a grade to view its available package options.
3 package records2 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251128 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
- Product code: LINF898273
870235-46-4 / 4-fluorothieno[2,3-c]pyridine-2-carboxylic acid
Basic Information
CAS
870235-46-4
Multi CAS
No
Molecular Formula
C8FH4NO2S
Molecular Weight
197.190000
Exact Mass
196.994678
InChI
InChI=1S/C8H4FNO2S/c9-5-2-10-3-7-4(5)1-6(13-7)8(11)12/h1-3H,(H,11,12)
InChIKey
HKXMBOHBJLYPJD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
46.54
TPSA
50.19
LogP / Solubility
WLOGP
2.13
MLOGP
1.88
XLogP3
1.8
Consensus LogP
1.94
Log S (ESOL)
-2.85
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.72
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.83
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)
-2.41
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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