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CAS 1576-37-0 N-Benzyl-p-toluenesulfonamide molecular structure lightbox
CAS RN: 1576-37-0

N-Benzyl-p-toluenesulfonamide

Product Availability

Choose a grade to view its available package options.

11 package records11 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250622 100g In stock Inquiry
Batchno.20250402 25g In stock Inquiry
Batchno.20260316 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250927 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Guangdong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250126 100g In stock Shanghai Inquiry
Batchno.20250417 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20250704 1mg In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20250408 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20250221 25g In stock Shanghai Inquiry
Batchno.20251124 50mg In stock Shanghai, Wuhan Inquiry
Batchno.20250429 5g In stock Shanghai, Shenzhen Inquiry
  • Product code: SSC-066471
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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: ≥98%
  • 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 1576-37-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥98% 0 Out of Stock Beijing Inquiry

1576-37-0 / N-benzyl-4-methylbenzenesulfonamide

Standard CAS: 1576-37-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1576-37-0
Multi CAS
No
Molecular Formula
C14H15NO2S
Molecular Weight
261.340000
Exact Mass
261.082350
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2
InChI
InChI=1S/C14H15NO2S/c1-12-7-9-14(10-8-12)18(16,17)15-11-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3
InChIKey
WTHKAJZQYNKTCJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
71.65
TPSA
46.17

LogP / Solubility

WLOGP
2.47
MLOGP
2.18
XLogP3
2.7
Consensus LogP
2.45
Log S (ESOL)
-3.25
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.49
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.89
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.56

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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