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CAS 20818-25-1 P-AMINOPHENYL BETA-D-GLUCOPYRANOSIDE molecular structure lightbox
CAS RN: 20818-25-1

P-AMINOPHENYL BETA-D-GLUCOPYRANOSIDE

Product Availability

Available package options are listed below.

3 package records2 with current stock
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251221 100mg In stock Inquiry
Batchno.20260422 100mg / 500mg / 1g / 5g Confirm by inquiry Shanghai, Shandong Inquiry
Batchno.20250707 500mg Out of stock Inquiry
  • Product code: SSC-097908
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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 20818-25-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry

20818-25-1 / (2S,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Standard CAS: 20818-25-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
20818-25-1
Multi CAS
No
Molecular Formula
C12H17NO6
Molecular Weight
271.270000
Exact Mass
271.105587
SMILES
C1=CC(=CC=C1N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
InChI
InChI=1S/C12H17NO6/c13-6-1-3-7(4-2-6)18-12-11(17)10(16)9(15)8(5-14)19-12/h1-4,8-12,14-17H,5,13H2/t8-,9-,10+,11-,12-/m1/s1
InChIKey
MIAKOEWBCMPCQR-RMPHRYRLSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
7
H-bond donors
5
Molar refractivity
65.25
TPSA
125.4

LogP / Solubility

WLOGP
-1.55
MLOGP
-1.36
XLogP3
-1
Consensus LogP
-1.3
Log S (ESOL)
-0.58
Class (ESOL)
Very soluble
Log S (Ali)
-0.66
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.49
Class (SILICOS-IT)
Very 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)
-5.48

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
4

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