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CAS 74707-05-4 2,5-Dibromo-3,4-dimethylthiophene molecular structure lightbox
CAS RN: 74707-05-4

2,5-Dibromo-3,4-dimethylthiophene

  • Product code: SSC-184161
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g
  • Available purity: >95%
  • Inventory rows with stock: 1
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 74707-05-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 5 In Stock Hong Kong Inquiry

74707-05-4 / 2,5-dibromo-3,4-dimethylthiophene

Standard CAS: 74707-05-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
74707-05-4
Multi CAS
Yes
Molecular Formula
C6H6BR2S
Molecular Weight
269.990000
Exact Mass
269.853650
InChI
InChI=1S/C6H6Br2S/c1-3-4(2)6(8)9-5(3)7/h1-2H3
InChIKey
NIDAFLYKBAFSNA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
5
Fraction Csp3
0.33
H-bond acceptors
1
Molar refractivity
49.19
TPSA
28.2000

LogP / Solubility

WLOGP
3.89
MLOGP
3.43
XLogP3
4.4
Consensus LogP
3.91
Log S (ESOL)
-4.38
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.58
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.64
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)
-1.61

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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