CAS RN: 864943-22-6

(R)-3,3′-Bis(9-phenanthrenyl)-1,1′-binaphthyl-2,2′-diyl Hydrogen Phosphate, 98%,ee99%

Product Availability

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7 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260515 100mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260120 10g In stock Shanghai Inquiry
Batchno.20260626 1g In stock Shanghai, Tianjin Inquiry
Batchno.20260528 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20260219 50mg In stock Shanghai, Shenzhen Inquiry
Batchno.20260623 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260102 25mg / 100mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-195605
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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 864943-22-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 0 Out of Stock Shanghai Inquiry

864943-22-6 / 13-hydroxy-10,16-di(phenanthren-9-yl)-12,14-dioxa-13lambda5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 13-oxide

Standard CAS: 864943-22-6 Multi CAS: No

Basic Information

CAS
864943-22-6
Multi CAS
No
Molecular Formula
C48H29O4P
Molecular Weight
700.700000
Exact Mass
700.180346
InChI
InChI=1S/C48H29O4P/c49-53(50)51-47-43(41-25-29-13-1-5-17-33(29)37-21-9-11-23-39(37)41)27-31-15-3-7-19-35(31)45(47)46-36-20-8-4-16-32(36)28-44(48(46)52-53)42-26-30-14-2-6-18-34(30)38-22-10-12-24-40(38)42/h1-28H,(H,49,50)
InChIKey
BVICVEIKBNVROI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
53
Aromatic heavy atom count
48
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
218.87
TPSA
55.76

LogP / Solubility

WLOGP
13.48
MLOGP
11.92
XLogP3
13.1
Consensus LogP
12.83
Log S (ESOL)
-13.21
Class (ESOL)
Insoluble
Log S (Ali)
-15.04
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-15.64
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
2.58

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
8

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