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CAS 4182-80-3 N,N,N’,N’-Tetrakis[4-(dibutylamino)phenyl]-1,4-phenylenediamine molecular structure lightbox
CAS RN: 4182-80-3

N,N,N’,N’-Tetrakis[4-(dibutylamino)phenyl]-1,4-phenylenediamine

Product Availability

Choose a grade to view its available package options.

4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260615 250mg / 1g / 5g Out of stock 15 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250521 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20260127 250mg In stock Shanghai, Wuhan Inquiry
Batchno.20260117 5g In stock Shanghai Inquiry
  • Product code: SSC-150171
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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: ＞97%
  • 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 4182-80-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

4182-80-3 / 1-N,1-N-dibutyl-4-N-[4-[4-(dibutylamino)-N-[4-(dibutylamino)phenyl]anilino]phenyl]-4-N-[4-(dibutylamino)phenyl]benzene-1,4-diamine

Standard CAS: 4182-80-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
4182-80-3
Multi CAS
Yes
Molecular Formula
C62H92N6
Molecular Weight
921.400000
Exact Mass
920.738347
InChI
InChI=1S/C62H92N6/c1-9-17-45-63(46-18-10-2)53-25-33-57(34-26-53)67(58-35-27-54(28-36-58)64(47-19-11-3)48-20-12-4)61-41-43-62(44-42-61)68(59-37-29-55(30-38-59)65(49-21-13-5)50-22-14-6)60-39-31-56(32-40-60)66(51-23-15-7)52-24-16-8/h25-44H,9-24,45-52H2,1-8H3
InChIKey
GVNSFLFOZIYBPH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
68
Aromatic heavy atom count
30
Fraction Csp3
0.52
Rotatable bonds
34
H-bond acceptors
6
Molar refractivity
303.92
TPSA
19.44

LogP / Solubility

WLOGP
18.25
MLOGP
16.15
XLogP3
18.9
Consensus LogP
17.77
Log S (ESOL)
-15.13
Class (ESOL)
Insoluble
Log S (Ali)
-20.29
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-24.88
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)
4.62

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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