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CAS 3283-05-4 N,N,N’,N’-Tetrakis(4-nitrophenyl)-1,4-phenylenediamine molecular structure lightbox
CAS RN: 3283-05-4

N,N,N’,N’-Tetrakis(4-nitrophenyl)-1,4-phenylenediamine

Product Availability

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2 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250505 1g In stock Shanghai Inquiry
Batchno.20260425 200mg In stock Shanghai, Shandong Inquiry
  • Product code: SSC-138570
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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 3283-05-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

3283-05-4 / 1-N,1-N,4-N,4-N-tetrakis(4-nitrophenyl)benzene-1,4-diamine

Standard CAS: 3283-05-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
3283-05-4
Multi CAS
Yes
Molecular Formula
C30H20N6O8
Molecular Weight
592.500000
Exact Mass
592.134262
InChI
InChI=1S/C30H20N6O8/c37-33(38)27-13-5-23(6-14-27)31(24-7-15-28(16-8-24)34(39)40)21-1-2-22(4-3-21)32(25-9-17-29(18-10-25)35(41)42)26-11-19-30(20-12-26)36(43)44/h1-20H
InChIKey
XEUNCVYZWDLKKR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
44
Aromatic heavy atom count
30
Rotatable bonds
10
H-bond acceptors
10
Molar refractivity
162.43
TPSA
179.04

LogP / Solubility

WLOGP
8.26
MLOGP
7.32
XLogP3
7.7
Consensus LogP
7.76
Log S (ESOL)
-8.56
Class (ESOL)
Insoluble
Log S (Ali)
-10.38
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.57
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)
-0.47

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
5

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