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CAS 146-80-5 Xanthosine Dihydrate molecular structure lightbox
CAS RN: 146-80-5

Xanthosine Dihydrate

Product Availability

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11 package records10 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251022 100mg In stock Inquiry
Batchno.20250404 2g Out of stock Inquiry
Batchno.20260209 500mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250425 100mg In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batchno.20250425 10g In stock Shandong Inquiry
Batchno.20250404 2g In stock Shanghai, Shandong Inquiry
Batchno.20250302 500mg In stock Shanghai, Shandong, Guangdong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251117 100mg In stock Shanghai Inquiry
Batchno.20250123 1g In stock Shanghai Inquiry
Batchno.20251226 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20251227 5g In stock Shanghai Inquiry
  • Product code: SSC-057149
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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: 1g
  • 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 146-80-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 0 Out of Stock Beijing Inquiry

146-80-5 / 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione

Standard CAS: 146-80-5 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
146-80-5
Multi CAS
No
Molecular Formula
C10H12N4O6
Molecular Weight
284.230000
Exact Mass
284.075684
SMILES
C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)NC(=O)NC2=O
InChI
InChI=1S/C10H12N4O6/c15-1-3-5(16)6(17)9(20-3)14-2-11-4-7(14)12-10(19)13-8(4)18/h2-3,5-6,9,15-17H,1H2,(H2,12,13,18,19)/t3-,5-,6-,9-/m1/s1
InChIKey
UBORTCNDUKBEOP-UUOKFMHZSA-N

Physical Properties

Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
9
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
8
H-bond donors
5
Molar refractivity
63.98
TPSA
153.46

LogP / Solubility

WLOGP
-2.98
MLOGP
-2.61
XLogP3
-2.4
Consensus LogP
-2.66
Log S (ESOL)
0.07
Class (ESOL)
Highly soluble
Log S (Ali)
0.26
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.72
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-6.57

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3.5

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