CAS RN: 83663-36-9
5-Bromo-2,3-dichlorothiophene
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.20260602 | 100mg / 250mg | Out of stock | 15 business days | Inquiry |
- Product code: LINB901606
83663-36-9 / 5-bromo-2,3-dichlorothiophene
Basic Information
CAS
83663-36-9
Multi CAS
No
Molecular Formula
C4HBRCL2S
Molecular Weight
231.920000
Exact Mass
229.835940
InChI
InChI=1S/C4HBrCl2S/c5-3-1-2(6)4(7)8-3/h1H
InChIKey
OLGYPVCRHVQYRC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Aromatic heavy atom count
5
H-bond acceptors
1
Molar refractivity
42.04
TPSA
28.2000
LogP / Solubility
WLOGP
3.82
MLOGP
3.36
XLogP3
4.2
Consensus LogP
3.79
Log S (ESOL)
-4.15
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.22
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.34
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.42
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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