![CAS 223725-09-5 (AS,AS)-1,1#-BIS[-(DIMETHYLAMINO)BENZYL]-(R,R)-2,2#-BIS(DIPHENYLPHOSPHINO molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/223725-09-5.gif)
CAS RN: 223725-09-5
(AS,AS)-1,1#-BIS[-(DIMETHYLAMINO)BENZYL]-(R,R)-2,2#-BIS(DIPHENYLPHOSPHINO
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260520 | 100mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry | |
| Batchno.20260215 | 1g | In stock | Shanghai, Chengdu | Inquiry | |
| Batchno.20250923 | 250mg | In stock | Shanghai, Wuhan | Inquiry | |
| Batchno.20260627 | 50mg | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20250217 | 50mg / 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20260204 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS223725-09-5
- Purity/Analytical Methods: >99.0%
223725-09-5 / (AS,AS)-1,1#-BIS[-(DIMETHYLAMINO)BENZYL]-(R,R)-2,2#-BIS(DIPHENYLPHOSPHINO
Basic Information
CAS
223725-09-5
Multi CAS
No
Molecular Formula
C52H50FeN2P2
Molecular Weight
820.800000
Exact Mass
820.279859
SMILES
CN(C)[C@@H](C1=CC=CC=C1)[C]2[CH][CH][CH][C]2P(C3=CC=CC=C3)C4=CC=CC=C4.CN(C)[C@@H](C1=CC=CC=C1)[C]2[CH][CH][CH][C]2P(C3=CC=CC=C3)C4=CC=CC=C4.[Fe]
InChI
InChI=1S/2C26H25NP.Fe/c2*1-27(2)26(21-13-6-3-7-14-21)24-19-12-20-25(24)28(22-15-8-4-9-16-22)23-17-10-5-11-18-23;/h2*3-20,26H,1-2H3;/t2*26-;/m00./s1
InChIKey
HZATWRYPFZEGHM-FKMBXMNYSA-N
Computed Properties
Structural Parameters
Heavy atom count
57
Aromatic heavy atom count
36
Fraction Csp3
0.12
Rotatable bonds
12
H-bond acceptors
2
Molar refractivity
242.66
TPSA
6.48
LogP / Solubility
WLOGP
10.31
MLOGP
9.15
XLogP3
10.31
Consensus LogP
9.92
Log S (ESOL)
-11.1
Class (ESOL)
Insoluble
Log S (Ali)
-13.73
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-14.99
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.41
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7.5
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