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CAS 105659-32-3 5-BROMO-2′,3′,5′-TRI-O-ACETYLURIDINE molecular structure lightbox
CAS RN: 105659-32-3

5-BROMO-2′,3′,5′-TRI-O-ACETYLURIDINE

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260417 100mg In stock Shanghai Inquiry
Batchno.20260421 100mg / 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
Batchno.20260117 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250716 250mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250417 5g In stock Shenzhen Inquiry
  • Product code: SSC-007374
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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: ＞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 105659-32-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

105659-32-3 / [(2R,3R,4R,5R)-3,4-diacetyloxy-5-(5-bromo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl acetate

Uridine, 5-bromo-,2',3',5'-triacetate (9CI) | [3,4-bis(acetyloxy)-5-(5-bromo-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl acetate | ChemDiv1_019943

Standard CAS: 105659-32-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
105659-32-3
Multi CAS
Yes
Molecular Formula
C15H17BrN2O9
Molecular Weight
449.210000
Exact Mass
448.011740
SMILES
CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=C(C(=O)NC2=O)Br)OC(=O)C)OC(=O)C
InChI
InChI=1S/C15H17BrN2O9/c1-6(19)24-5-10-11(25-7(2)20)12(26-8(3)21)14(27-10)18-4-9(16)13(22)17-15(18)23/h4,10-12,14H,5H2,1-3H3,(H,17,22,23)/t10-,11-,12-,14-/m1/s1
InChIKey
OVWGEZUVGHETAU-HKUMRIAESA-N
Synonyms
Uridine, 5-bromo-,2',3',5'-triacetate (9CI) [3,4-bis(acetyloxy)-5-(5-bromo-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl acetate ChemDiv1_019943 2',3',5'-Tri-O-acetyl-5-bromouridine Oprea1_773424

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
6
Fraction Csp3
0.53
Rotatable bonds
5
H-bond acceptors
10
H-bond donors
1
Molar refractivity
90.67
TPSA
142.99

LogP / Solubility

WLOGP
-0.38
MLOGP
-0.3
XLogP3
0.4
Consensus LogP
-0.09
Log S (ESOL)
-2.22
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.97
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.87
Class (SILICOS-IT)
Moderately 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)
-5.73

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5

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