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CAS 309735-86-2 [NH2Me2][(RuCl((S)-tolbinap))2(μ-Cl)3] molecular structure lightbox
CAS RN: 309735-86-2

[NH2Me2][(RuCl((S)-tolbinap))2(μ-Cl)3]

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260125 200mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-136137
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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: 95%+
  • 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 309735-86-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g 95%+ 0 Out of Stock Hong Kong Inquiry

309735-86-2 / bis([1-[2-bis(4-methylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(4-methylphenyl)phosphane);bis(dichlororuthenium);N-methylmethanamine;hydrochloride

Standard CAS: 309735-86-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
309735-86-2
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
1
H-bond donors
1
Molar refractivity
492.14
TPSA
12.03

LogP / Solubility

WLOGP
23.83
MLOGP
21.16
XLogP3
23.83
Consensus LogP
22.94
Log S (ESOL)
-25.58
Class (ESOL)
Insoluble
Log S (Ali)
-31.39
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-32.71
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)
3.32

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
10

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