![CAS 1816286-21-1 Tetrakis[n-tetrachlorophthaloyl-(s)-tert-leucinato]dirhodium bis(ethyl acetate) adduct molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1816286-21-1.gif)
CAS RN: 1816286-21-1
Tetrakis[n-tetrachlorophthaloyl-(s)-tert-leucinato]dirhodium bis(ethyl acetate) adduct
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260613 | 100mg | In stock | Shanghai, Shenzhen, Wuhan, Chengdu | Inquiry | |
| Batchno.20250312 | 1g | In stock | Shenzhen, Chengdu | Inquiry | |
| Batchno.20250424 | 250mg | In stock | Shenzhen, Chengdu | Inquiry | |
| Batchno.20250604 | 50mg | Out of stock | Inquiry | ||
| Batchno.20260523 | 50mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-082523
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
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥97% | 0 Out of Stock | Hong Kong | Inquiry |
1816286-21-1 / tetrakis((2S)-3,3-dimethyl-2-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)butanoate);bis(rhodium(2+))
Basic Information
CAS
1816286-21-1
Multi CAS
No
Molecular Formula
C56H40Cl16N4O16Rh2
Molecular Weight
1798.000000
Exact Mass
1797.544760
SMILES
CC(C)(C)[C@@H](C(=O)[O-])N1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl.CC(C)(C)[C@@H](C(=O)[O-])N1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl.CC(C)(C)[C@@H](C(=O)[O-])N1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl.CC(C)(C)[C@@H](C(=O)[O-])N1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl.[Rh+2].[Rh+2]
InChI
InChI=1S/4C14H11Cl4NO4.2Rh/c4*1-14(2,3)10(13(22)23)19-11(20)4-5(12(19)21)7(16)9(18)8(17)6(4)15;;/h4*10H,1-3H3,(H,22,23);;/q;;;;2*+2/p-4/t4*10-;;/m1111../s1
InChIKey
VOPFDGCIUABLIB-MYHKTDPMSA-J
Computed Properties
Structural Parameters
Heavy atom count
94
Aromatic heavy atom count
24
Fraction Csp3
0.36
Rotatable bonds
8
H-bond acceptors
16
Molar refractivity
340.93
TPSA
310.04
LogP / Solubility
WLOGP
12.24
MLOGP
10.96
XLogP3
12.24
Consensus LogP
11.81
Log S (ESOL)
-18.36
Class (ESOL)
Insoluble
Log S (Ali)
-23.14
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-22.46
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-5
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
8.5
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