CAS RN: 2089651-77-2
7-BROMO-4-CHLORO-8-FLUOROQUINAZOLINE
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250313 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250530 | 1g | Out of stock | Inquiry | ||
| Batchno.20251027 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260202 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250118 | 50mg / 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2089651-77-2
- Purity/Analytical Methods: >99.0%
2089651-77-2 / 7-bromo-4-chloro-8-fluoroquinazoline
Basic Information
CAS
2089651-77-2
Multi CAS
No
Molecular Formula
C8H3BrClFN2
Molecular Weight
261.480000
Exact Mass
259.915220
SMILES
C1=CC(=C(C2=C1C(=NC=N2)Cl)F)Br
InChI
InChI=1S/C8H3BrClFN2/c9-5-2-1-4-7(6(5)11)12-3-13-8(4)10/h1-3H
InChIKey
SBXSLMOKYJUWJZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
10
H-bond acceptors
2
Molar refractivity
52.21
TPSA
25.78
LogP / Solubility
WLOGP
3.18
MLOGP
2.81
XLogP3
3.3
Consensus LogP
3.1
Log S (ESOL)
-4.04
Class (ESOL)
Slightly soluble
Log S (Ali)
-4
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.05
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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