![CAS 749935-02-2 [NH2Me2][(RuCl((R)-tolbinap))2(μ-Cl)3] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/n1017-jpgcontextbwfzdgvyfhjvb3r8mzewodn8aw1hz2uvanblz3xonguvadywlzg5mze3ndy5mdyxndivtjewmtcuanbnfdqyn2jjmwqzmdixytg4odq2mduyntyzodbjmgq5ota1ywnjnjhmmdc0otvjm2niy2y0zwjkogriyjdjodyxmta.jpeg)
CAS RN: 749935-02-2
[NH2Me2][(RuCl((R)-tolbinap))2(μ-Cl)3]
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260513 | 200mg | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-184509
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: ＞95%
- 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 | ＞95% | 0 Out of Stock | Beijing | Inquiry |
749935-02-2 / bis([1-[2-bis(4-methylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(4-methylphenyl)phosphane);dimethylazanium;bis(ruthenium(2+));pentachloride
Basic Information
CAS
749935-02-2
Multi CAS
Yes
Molecular Formula
C98H88CL5NP4RU2
Molecular Weight
1783.000000
Exact Mass
1786.241160
InChI
InChI=1S/2C48H40P2.C2H7N.5ClH.2Ru/c2*1-33-13-23-39(24-14-33)49(40-25-15-34(2)16-26-40)45-31-21-37-9-5-7-11-43(37)47(45)48-44-12-8-6-10-38(44)22-32-46(48)50(41-27-17-35(3)18-28-41)42-29-19-36(4)20-30-42;1-3-2;;;;;;;/h2*5-32H,1-4H3;3H,1-2H3;5*1H;;/q;;;;;;;;2*+2/p-4
InChIKey
FAAFCSOHMVBJIS-UHFFFAOYSA-J
Computed Properties
Structural Parameters
Heavy atom count
110
Aromatic heavy atom count
88
Fraction Csp3
0.1
Rotatable bonds
14
H-bond acceptors
5
H-bond donors
1
Molar refractivity
460.27
TPSA
16.61
LogP / Solubility
WLOGP
4.64
MLOGP
4.28
XLogP3
4.64
Consensus LogP
4.52
Log S (ESOL)
-13.49
Class (ESOL)
Insoluble
Log S (Ali)
-17.53
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-16.79
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
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)
-10.3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10
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