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CAS 914458-42-7 JWH 309 molecular structure lightbox
CAS RN: 914458-42-7

JWH 309

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260609 10mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS914458-42-7
  • Purity/Analytical Methods: >99.0%
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914458-42-7 / naphthalen-1-yl-(5-naphthalen-1-yl-1-pentylpyrrol-3-yl)methanone

Standard CAS: 914458-42-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
914458-42-7
Multi CAS
No
Molecular Formula
C30H27NO
Molecular Weight
417.500000
Exact Mass
417.209264
InChI
InChI=1S/C30H27NO/c1-2-3-8-19-31-21-24(30(32)28-18-10-14-23-12-5-7-16-26(23)28)20-29(31)27-17-9-13-22-11-4-6-15-25(22)27/h4-7,9-18,20-21H,2-3,8,19H2,1H3
InChIKey
WVISOUYKTUUDFW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
25
Fraction Csp3
0.17
Rotatable bonds
7
H-bond acceptors
2
Molar refractivity
134.28
TPSA
22

LogP / Solubility

WLOGP
7.88
MLOGP
6.96
XLogP3
7.9
Consensus LogP
7.58
Log S (ESOL)
-7.51
Class (ESOL)
Insoluble
Log S (Ali)
-8.68
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.76
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)
0.33

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
3.5

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