CAS RN: 38186-87-7
5-fluoro-6-bromonicotinc acid
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.20260518 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS38186-87-7
- Purity/Analytical Methods: >99.0%
38186-87-7 / 6-bromo-5-fluoropyridine-3-carboxylic acid
Basic Information
CAS
38186-87-7
Multi CAS
No
Molecular Formula
BC6H3NO2Rf
Molecular Weight
220.000000
Exact Mass
218.933120
InChI
InChI=1S/C6H3BrFNO2/c7-5-4(8)1-3(2-9-5)6(10)11/h1-2H,(H,10,11)
InChIKey
YYLYQDSWERQSTR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
38.85
TPSA
50.19
LogP / Solubility
WLOGP
1.68
MLOGP
1.48
XLogP3
1.5
Consensus LogP
1.55
Log S (ESOL)
-2.6
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.58
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.61
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)
-2.87
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
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- CAS RN: 38201-61-5
- Product Code: starshine_CAS38201-61-5
- Purity/Analytical method: >99.0%
