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CAS 1984-25-4 4-BROMO-N-ETHYLBENZENESULPHONAMIDE molecular structure lightbox
CAS RN: 1984-25-4

4-BROMO-N-ETHYLBENZENESULPHONAMIDE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251101 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-093474
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 10g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1984-25-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ＞97% 0 Out of Stock Shanghai Inquiry

1984-25-4 / 4-bromo-N-ethylbenzenesulfonamide

Standard CAS: 1984-25-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1984-25-4
Multi CAS
No
Molecular Formula
C8H10BrNO2S
Molecular Weight
264.140000
Exact Mass
262.961560
SMILES
CCNS(=O)(=O)C1=CC=C(C=C1)Br
InChI
InChI=1S/C8H10BrNO2S/c1-2-10-13(11,12)8-5-3-7(9)4-6-8/h3-6,10H,2H2,1H3
InChIKey
CEPUEFFXFOOTDZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
55
TPSA
46.17

LogP / Solubility

WLOGP
1.75
MLOGP
1.55
XLogP3
1.9
Consensus LogP
1.73
Log S (ESOL)
-2.72
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.99
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.19
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.09

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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