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CAS 15266-38-3 evocarpine molecular structure lightbox
CAS RN: 15266-38-3

evocarpine

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251027 5mg Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250515 10mg In stock Shanghai Inquiry
Batchno.20260125 25mg In stock Shanghai Inquiry
Batchno.20260227 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS15266-38-3
  • Purity/Analytical Methods: >99.0%
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15266-38-3 / 1-methyl-2-[(Z)-tridec-8-enyl]quinolin-4-one

Standard CAS: 15266-38-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
15266-38-3
Multi CAS
No
Molecular Formula
C23H33NO
Molecular Weight
339.500000
Exact Mass
339.256215
SMILES
CCCC/C=C\CCCCCCCC1=CC(=O)C2=CC=CC=C2N1C
InChI
InChI=1S/C23H33NO/c1-3-4-5-6-7-8-9-10-11-12-13-16-20-19-23(25)21-17-14-15-18-22(21)24(20)2/h6-7,14-15,17-19H,3-5,8-13,16H2,1-2H3/b7-6-
InChIKey
HWFYWIVOYBPLQU-SREVYHEPSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
10
Fraction Csp3
0.52
Rotatable bonds
11
H-bond acceptors
2
Molar refractivity
109.26
TPSA
22

LogP / Solubility

WLOGP
6.17
MLOGP
5.44
XLogP3
7.3
Consensus LogP
6.3
Log S (ESOL)
-5.4
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.8
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.31
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
No
Log Kp (skin permeation)
-0.41

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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