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CAS 38048-32-7 S-(4-NITROBENZYL)-6-THIOINOSINE molecular structure lightbox
CAS RN: 38048-32-7

S-(4-NITROBENZYL)-6-THIOINOSINE

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251216 25mg / 100mg / 250mg Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250401 100mg In stock Shanghai Inquiry
Batchno.20251105 1g In stock Shanghai Inquiry
Batchno.20260515 1mg In stock Shanghai, Wuhan Inquiry
Batchno.20251214 250mg In stock Shanghai Inquiry
Batchno.20250518 25mg In stock Shanghai Inquiry
Batchno.20250325 50mg In stock Shanghai Inquiry
  • Product code: SSC-145535
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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: 0.25g
  • 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 38048-32-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

38048-32-7 / 2-(hydroxymethyl)-5-[6-[(4-nitrophenyl)methylsulfanyl]purin-9-yl]oxolane-3,4-diol

Standard CAS: 38048-32-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
38048-32-7
Multi CAS
Yes
Molecular Formula
C17H17N5O6S
Molecular Weight
419.400000
Exact Mass
419.089954
InChI
InChI=1S/C17H17N5O6S/c23-5-11-13(24)14(25)17(28-11)21-8-20-12-15(21)18-7-19-16(12)29-6-9-1-3-10(4-2-9)22(26)27/h1-4,7-8,11,13-14,17,23-25H,5-6H2/t11-,13-,14-,17-/m1/s1
InChIKey
DYCJFJRCWPVDHY-LSCFUAHRSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Aromatic heavy atom count
15
Fraction Csp3
0.35
Rotatable bonds
6
H-bond acceptors
11
H-bond donors
3
Molar refractivity
100.99
TPSA
156.66

LogP / Solubility

WLOGP
0.64
MLOGP
0.59
XLogP3
1.5
Consensus LogP
0.91
Log S (ESOL)
-2.83
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.46
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.64
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.83

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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