![CAS 486429-95-2 Phosphine, 1,1′-[(15aS)-7,8,9,10-tetrahydro-6H-dibenzo[b,d][1,6]dioxacycloundecin-1,15-diyl]bis[1,1-diphenyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/486429-95-2.gif)
CAS RN: 486429-95-2
Phosphine, 1,1′-[(15aS)-7,8,9,10-tetrahydro-6H-dibenzo[b,d][1,6]dioxacycloundecin-1,15-diyl]bis[1,1-diphenyl-
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251119 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20251228 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250506 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250227 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250327 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250124 | 5g | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS486429-95-2
- Purity/Analytical Methods: >99.0%
486429-95-2 / (19-diphenylphosphanyl-8,14-dioxatricyclo[13.4.0.02,7]nonadeca-1(15),2(7),3,5,16,18-hexaen-3-yl)-diphenylphosphane
Basic Information
CAS
486429-95-2
Multi CAS
No
Molecular Formula
C41H36O2P2
Molecular Weight
622.700000
Exact Mass
622.219054
InChI
InChI=1S/C41H36O2P2/c1-6-18-32(19-7-1)44(33-20-8-2-9-21-33)38-28-16-26-36-40(38)41-37(43-31-15-5-14-30-42-36)27-17-29-39(41)45(34-22-10-3-11-23-34)35-24-12-4-13-25-35/h1-4,6-13,16-29H,5,14-15,30-31H2
InChIKey
ZJSLWYGVDOSDNF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
45
Aromatic heavy atom count
36
Fraction Csp3
0.12
Rotatable bonds
6
H-bond acceptors
2
Molar refractivity
194.13
TPSA
18.46
LogP / Solubility
WLOGP
7.81
MLOGP
6.92
XLogP3
9.7
Consensus LogP
8.14
Log S (ESOL)
-8.82
Class (ESOL)
Insoluble
Log S (Ali)
-10.31
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.91
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)
-0.97
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
7.5
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