CAS RN: 84656-77-9
4′-Propyl-4-(4-propyl-phenyl)-bicyclohexyl
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251022 | 5g / 25g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS84656-77-9
- Purity/Analytical Methods: >99.0%
84656-77-9 / 1-propyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
Basic Information
CAS
84656-77-9
Multi CAS
No
Molecular Formula
C24H38
Molecular Weight
326.600000
Exact Mass
326.297351
InChI
InChI=1S/C24H38/c1-3-5-19-7-11-21(12-8-19)23-15-17-24(18-16-23)22-13-9-20(6-4-2)10-14-22/h7-8,11-12,20,22-24H,3-6,9-10,13-18H2,1-2H3
InChIKey
WQGMAFRSIHBDRV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
6
Fraction Csp3
0.75
Rotatable bonds
6
Molar refractivity
105.49
TPSA
0.0000
LogP / Solubility
WLOGP
7.52
MLOGP
6.63
XLogP3
9.6
Consensus LogP
7.92
Log S (ESOL)
-6.39
Class (ESOL)
Insoluble
Log S (Ali)
-7.67
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.74
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
0.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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