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CAS 4691-65-0 Disodium 5′-Inosinate molecular structure lightbox
CAS RN: 4691-65-0

Disodium 5′-Inosinate

  • Product code: SSC-154040
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 5g, 10g, 25g, 100g, 500g
  • Available purity: >97%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 4691-65-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 5 In Stock Shanghai Inquiry
10g >97% 5 In Stock Hong Kong Inquiry
25g >97% 5 In Stock Shanghai Inquiry
100g >97% 0 Out of Stock Shenzhen Inquiry
500g >97% 0 Out of Stock Hong Kong Inquiry

4691-65-0 / disodium;[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-oxo-1H-purin-9-yl)oxolan-2-yl]methyl phosphate

Standard CAS: 4691-65-0 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
4691-65-0
Multi CAS
Yes
Molecular Formula
C10H11N4NA2O8P
Molecular Weight
392.170000
Exact Mass
392.010989
InChI
InChI=1S/C10H13N4O8P.2Na/c15-6-4(1-21-23(18,19)20)22-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17;;/h2-4,6-7,10,15-16H,1H2,(H,11,12,17)(H2,18,19,20);;/q;2*+1/p-2/t4-,6-,7-,10-;;/m1../s1
InChIKey
AANLCWYVVNBGEE-IDIVVRGQSA-L

Physical Properties

Physical Description
Odourless, colourless or white crystals or powder
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
9
Fraction Csp3
0.5
Rotatable bonds
4
H-bond acceptors
11
H-bond donors
3
Molar refractivity
67.63
TPSA
185.68

LogP / Solubility

WLOGP
-9.41
MLOGP
-8.26
XLogP3
-9.41
Consensus LogP
-9.03
Log S (ESOL)
3.65
Class (ESOL)
Highly soluble
Log S (Ali)
4.02
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
5.12
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)
-11.79

Drug-likeness / Medicinal Chemistry

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

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