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CAS RN: 1435934-47-6
JWH 019 N-(5-hydroxyhexyl) metabolite
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.20260315 | 1mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1435934-47-6
- Purity/Analytical Methods: >99.0%
1435934-47-6 / [1-(5-hydroxyhexyl)indol-3-yl]-naphthalen-1-ylmethanone
Basic Information
CAS
1435934-47-6
Multi CAS
No
Molecular Formula
C25H25NO2
Molecular Weight
371.500000
Exact Mass
371.188529
SMILES
CC(CCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=CC=CC=C43)O
InChI
InChI=1S/C25H25NO2/c1-18(27)9-6-7-16-26-17-23(21-13-4-5-15-24(21)26)25(28)22-14-8-11-19-10-2-3-12-20(19)22/h2-5,8,10-15,17-18,27H,6-7,9,16H2,1H3
InChIKey
OMWLYFDUQMJPOS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
19
Fraction Csp3
0.24
Rotatable bonds
7
H-bond acceptors
3
H-bond donors
1
Molar refractivity
114.85
TPSA
42.23
LogP / Solubility
WLOGP
5.58
MLOGP
4.93
XLogP3
5.3
Consensus LogP
5.27
Log S (ESOL)
-5.7
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.63
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.54
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
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)
-1.03
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5
Safety & Transport
Pictogram(s)
Acute Toxic
Signal
Danger
GHS Hazard Statements
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P316, P321, P330, P405, and P501
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