CAS RN: 1227576-86-4
5-FLUORO-2-HYDROXY-4-IODOPYRIDINE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250314 | 100mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1227576-86-4
- Purity/Analytical Methods: >99.0%
1227576-86-4 / 5-fluoro-4-iodo-1H-pyridin-2-one
Basic Information
CAS
1227576-86-4
Multi CAS
No
Molecular Formula
C5H3FINO
Molecular Weight
238.990000
Exact Mass
238.924340
SMILES
C1=C(C(=CNC1=O)F)I
InChI
InChI=1S/C5H3FINO/c6-3-2-8-5(9)1-4(3)7/h1-2H,(H,8,9)
InChIKey
MFEDNNMGKYTJLJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
1
H-bond donors
1
Molar refractivity
39.74
TPSA
32.86
LogP / Solubility
WLOGP
1.12
MLOGP
0.99
XLogP3
0.2
Consensus LogP
0.77
Log S (ESOL)
-2.52
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.33
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.14
Class (SILICOS-IT)
Moderately 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)
-3.38
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
4-IODO-2-METHOXY-5-(TRIFLUOROMETHYL)PYRIDINE
- CAS RN: 1227577-09-4
- Product Code: SSC-026057
-
6-fluoro-4-Methylpyridin-3-ol
- CAS RN: 1227577-18-5
- Product Code: starshine_CAS1227577-18-5
- Purity/Analytical method: >99.0%
-
-
