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CAS 30153-46-9 4-BroMo-2,3-diMethylthiophene, .2 molecular structure lightbox
CAS RN: 30153-46-9

4-BroMo-2,3-diMethylthiophene, .2

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250225 1g In stock Inquiry
Batchno.20260516 250mg In stock Inquiry
Batchno.20260328 5g In stock Inquiry
  • Product code: starshine_CAS30153-46-9
  • Purity/Analytical Methods: >99.0%
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30153-46-9 / 4-bromo-2,3-dimethylthiophene

Standard CAS: 30153-46-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
30153-46-9
Multi CAS
No
Molecular Formula
C6H7BRS
Molecular Weight
191.090000
Exact Mass
189.945180
InChI
InChI=1S/C6H7BrS/c1-4-5(2)8-3-6(4)7/h3H,1-2H3
InChIKey
GJHAWQJOXYVXFF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.33
H-bond acceptors
1
Molar refractivity
41.49
TPSA
28.2000

LogP / Solubility

WLOGP
3.13
MLOGP
2.75
XLogP3
3.1
Consensus LogP
2.99
Log S (ESOL)
-3.46
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.38
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.5
Class (SILICOS-IT)
Poorly 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)
-1.67

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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