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CAS 38465-55-3 Bis(4-dimethylaminodithiobenzil)nickel(II) molecular structure lightbox
CAS RN: 38465-55-3

Bis(4-dimethylaminodithiobenzil)nickel(II)

Product Availability

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3 package records1 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251210 100mg In stock Inquiry
Batchno.20250619 1g Out of stock Inquiry
Batchno.20250512 200mg Out of stock Inquiry
  • Product code: SSC-146100
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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 38465-55-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

38465-55-3 / bis(1-[4-(dimethylamino)phenyl]-2-phenylethane-1,2-dithione);nickel

Standard CAS: 38465-55-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
38465-55-3
Multi CAS
Yes
Molecular Formula
C32H30IN3S4
Molecular Weight
629.600000
Exact Mass
628.064525
InChI
InChI=1S/2C16H15NS2.Ni/c2*1-17(2)14-10-8-13(9-11-14)16(19)15(18)12-6-4-3-5-7-12;/h2*3-11H,1-2H3;
InChIKey
GZRZIVBGDNCIOR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
39
Aromatic heavy atom count
24
Fraction Csp3
0.12
Rotatable bonds
8
H-bond acceptors
6
Molar refractivity
181.22
TPSA
6.48

LogP / Solubility

WLOGP
7.78
MLOGP
6.89
XLogP3
7.78
Consensus LogP
7.48
Log S (ESOL)
-8.57
Class (ESOL)
Insoluble
Log S (Ali)
-10.34
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.17
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)
-1.04

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5

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