![CAS 1105187-43-6 7-Bromo-4-chlorofuro[3,2-c]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1105187-43-6.gif)
CAS RN: 1105187-43-6
7-Bromo-4-chlorofuro[3,2-c]pyridine
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.20251226 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1105187-43-6
- Purity/Analytical Methods: >99.0%
1105187-43-6 / 7-bromo-4-chlorofuro[3,2-c]pyridine
7-Bromo-4-chlorofuro[3,2-c]pyridine | MFCD11846191 | 7-bromo-4-chloro-furo[3,2-c]pyridine
Basic Information
CAS
1105187-43-6
Multi CAS
No
Molecular Formula
C7H3BrClNO
Molecular Weight
232.460000
Exact Mass
230.908650
SMILES
C1=COC2=C1C(=NC=C2Br)Cl
InChI
InChI=1S/C7H3BrClNO/c8-5-3-10-7(9)4-1-2-11-6(4)5/h1-3H
InChIKey
XEKOTRYFIYDUEL-UHFFFAOYSA-N
Synonyms
7-Bromo-4-chlorofuro[3,2-c]pyridine
MFCD11846191
7-bromo-4-chloro-furo[3,2-c]pyridine
SC2721
SCHEMBL26040377
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
Molar refractivity
46.72
TPSA
26.03
LogP / Solubility
WLOGP
3.24
MLOGP
2.86
XLogP3
2.9
Consensus LogP
3
Log S (ESOL)
-3.93
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.81
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.86
Class (SILICOS-IT)
Poorly 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)
-1.84
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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