![CAS 1260382-02-2 1H-Pyrrolo[2,3-c]pyridine, 5-chloro-4-fluoro- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1260382-02-2.gif)
CAS RN: 1260382-02-2
1H-Pyrrolo[2,3-c]pyridine, 5-chloro-4-fluoro-
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.20250517 | 100mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1260382-02-2
- Purity/Analytical Methods: >99.0%
1260382-02-2 / 5-chloro-4-fluoro-1H-pyrrolo[2,3-c]pyridine
Basic Information
CAS
1260382-02-2
Multi CAS
No
Molecular Formula
C7H4ClFN2
Molecular Weight
170.570000
Exact Mass
170.004704
SMILES
C1=CNC2=CN=C(C(=C21)F)Cl
InChI
InChI=1S/C7H4ClFN2/c8-7-6(9)4-1-2-10-5(4)3-11-7/h1-3,10H
InChIKey
CVWVGMJSCJUFDE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
1
H-bond donors
1
Molar refractivity
41.06
TPSA
28.68
LogP / Solubility
WLOGP
2.36
MLOGP
2.07
XLogP3
2
Consensus LogP
2.14
Log S (ESOL)
-2.99
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.66
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.72
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)
-2.09
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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