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CAS 79791-38-1 Dodecylbenzenesulfonyl Azide (soft type) (mixture) molecular structure lightbox
CAS RN: 79791-38-1

Dodecylbenzenesulfonyl Azide (soft type) (mixture)

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250420 100g In stock Inquiry
Batchno.20250110 25g In stock Inquiry
Batchno.20250807 500g Out of stock Inquiry
Batchno.20250902 5g In stock Inquiry
  • Product code: SSC-188870
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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: 100g
  • Available purity: ≥95%
  • 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 79791-38-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥95% 0 Out of Stock Beijing Inquiry

79791-38-1 / N-diazo-4-dodecylbenzenesulfonamide

Standard CAS: 79791-38-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
79791-38-1
Multi CAS
Yes
Molecular Formula
C18H29N3O2S
Molecular Weight
351.500000
Exact Mass
351.198048
InChI
InChI=1S/C18H29N3O2S/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)24(22,23)21-20-19/h13-16H,2-12H2,1H3
InChIKey
DYEGEQTYEIHCSO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
6
Fraction Csp3
0.67
Rotatable bonds
13
H-bond acceptors
2
Molar refractivity
98.32
TPSA
82.9

LogP / Solubility

WLOGP
6.15
MLOGP
5.43
XLogP3
8.6
Consensus LogP
6.73
Log S (ESOL)
-5.22
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.88
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.61
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.5

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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