CAS RN: 1427325-68-5
JWH 122 6-methylnaphthyl isomer
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.20250722 | 1mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1427325-68-5
- Purity/Analytical Methods: >99.0%
1427325-68-5 / (6-methylnaphthalen-1-yl)-(1-pentylindol-3-yl)methanone
Basic Information
CAS
1427325-68-5
Multi CAS
No
Molecular Formula
C25H25NO
Molecular Weight
355.500000
Exact Mass
355.193614
SMILES
CCCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=C3C=CC(=C4)C
InChI
InChI=1S/C25H25NO/c1-3-4-7-15-26-17-23(21-10-5-6-12-24(21)26)25(27)22-11-8-9-19-16-18(2)13-14-20(19)22/h5-6,8-14,16-17H,3-4,7,15H2,1-2H3
InChIKey
QGZBPEQODUAQNS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
19
Fraction Csp3
0.24
Rotatable bonds
6
H-bond acceptors
2
Molar refractivity
113.58
TPSA
22
LogP / Solubility
WLOGP
6.52
MLOGP
5.76
XLogP3
6.7
Consensus LogP
6.33
Log S (ESOL)
-6.28
Class (ESOL)
Insoluble
Log S (Ali)
-7.19
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.11
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.26
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
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![CAS 1427325-83-4 1-[1-(5-hydroxypentyl)indol-3-yl]-2-(2-methoxyphenyl)ethanone molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1427325-83-4.gif)
