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CAS 897671-42-0 N4,N4-di(biphenyl-4-yl)-N4′-(naphthalen-1-yl)-N4′-phenyl-biphenyl-4,4′-diamine molecular structure lightbox
CAS RN: 897671-42-0

N4,N4-di(biphenyl-4-yl)-N4′-(naphthalen-1-yl)-N4′-phenyl-biphenyl-4,4′-diamine

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250622 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-201803
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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 897671-42-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

897671-42-0 / N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]naphthalen-1-amine

Standard CAS: 897671-42-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
897671-42-0
Multi CAS
No
Molecular Formula
C52H38N2
Molecular Weight
690.900000
Exact Mass
690.303499
InChI
InChI=1S/C52H38N2/c1-4-13-39(14-5-1)41-23-31-47(32-24-41)53(48-33-25-42(26-34-48)40-15-6-2-7-16-40)49-35-27-43(28-36-49)44-29-37-50(38-30-44)54(46-19-8-3-9-20-46)52-22-12-18-45-17-10-11-21-51(45)52/h1-38H
InChIKey
SPRHUSPHXCJHEL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
54
Aromatic heavy atom count
52
Rotatable bonds
9
H-bond acceptors
2
Molar refractivity
229.62
TPSA
6.48

LogP / Solubility

WLOGP
14.78
MLOGP
13.07
XLogP3
14.5
Consensus LogP
14.12
Log S (ESOL)
-13.55
Class (ESOL)
Insoluble
Log S (Ali)
-15.9
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-17.5
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)
3.56

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
7

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