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CAS 1461750-25-3 (3R,4S,5R,6R)-3,4,5-TRIS(BENZYLOXY)-TETRAHYDRO-6-METHYLPYRAN-2-ONE molecular structure lightbox
CAS RN: 1461750-25-3

(3R,4S,5R,6R)-3,4,5-TRIS(BENZYLOXY)-TETRAHYDRO-6-METHYLPYRAN-2-ONE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250919 100mg / 250mg / 1g Confirm by inquiry Shanghai 5-7 business days Inquiry
  • Product code: SSC-057301
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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 1461750-25-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

1461750-25-3 / (3R,4S,5R,6R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-one

Standard CAS: 1461750-25-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1461750-25-3
Multi CAS
No
Molecular Formula
C27H28O5
Molecular Weight
432.500000
Exact Mass
432.193674
SMILES
C[C@@H]1[C@H]([C@@H]([C@H](C(=O)O1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4
InChI
InChI=1S/C27H28O5/c1-20-24(29-17-21-11-5-2-6-12-21)25(30-18-22-13-7-3-8-14-22)26(27(28)32-20)31-19-23-15-9-4-10-16-23/h2-16,20,24-26H,17-19H2,1H3/t20-,24-,25+,26-/m1/s1
InChIKey
SFKYGYRKFMUHAD-YEHREXKJSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
18
Fraction Csp3
0.3
Rotatable bonds
9
H-bond acceptors
5
Molar refractivity
120.61
TPSA
53.99

LogP / Solubility

WLOGP
4.69
MLOGP
4.15
XLogP3
4.6
Consensus LogP
4.48
Log S (ESOL)
-5.3
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.49
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.44
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.03

Drug-likeness / Medicinal Chemistry

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

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