![CAS 58473-78-2 1,1-Bis[4-[N,N-di(p-tolyl)amino]phenyl]cyclohexane (purified) molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b3146-jpgcontextbwfzdgvyfhjvb3r8mzuzmdf8aw1hz2uvanblz3xomgyvadewlzg5mjg5mtc1mja0mtqvqjmxndyuanbnfdu2odg4ymzjm2iyztfizjg0ytfmm2zindrkm2y1ogfjogeynzi5mgezytrjotrlztqzogjlzdllngq4odazztu.jpeg)
CAS RN: 58473-78-2
1,1-Bis[4-[N,N-di(p-tolyl)amino]phenyl]cyclohexane (purified)
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock3 grade groups
- Product code: SSC-166709
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: ≥99%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥99% | 0 Out of Stock | Shenzhen | Inquiry |
58473-78-2 / 4-methyl-N-[4-[1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]cyclohexyl]phenyl]-N-(4-methylphenyl)aniline
Basic Information
CAS
58473-78-2
Multi CAS
Yes
Molecular Formula
C46H46N2
Molecular Weight
626.900000
Exact Mass
626.366099
InChI
InChI=1S/C46H46N2/c1-34-8-20-40(21-9-34)47(41-22-10-35(2)11-23-41)44-28-16-38(17-29-44)46(32-6-5-7-33-46)39-18-30-45(31-19-39)48(42-24-12-36(3)13-25-42)43-26-14-37(4)15-27-43/h8-31H,5-7,32-33H2,1-4H3
InChIKey
ZOKIJILZFXPFTO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
48
Aromatic heavy atom count
36
Fraction Csp3
0.22
Rotatable bonds
8
H-bond acceptors
2
Molar refractivity
205.06
TPSA
6.48
LogP / Solubility
WLOGP
13.11
MLOGP
11.59
XLogP3
14.1
Consensus LogP
12.93
Log S (ESOL)
-12.01
Class (ESOL)
Insoluble
Log S (Ali)
-14.17
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-15.58
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)
2.76
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
6
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