CAS RN: 35467-43-7
(3β,16E)-16,17,18,19-Tetradehydro-17-methoxycorynan-16-carboxylic acid methyl ester
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260314 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250223 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20251217 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250712 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20251111 | 5mg | In stock | Shanghai, Shandong | Inquiry |
| Batchno.20250912 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS35467-43-7
- Purity/Analytical Methods: >99.0%
35467-43-7 / methyl 2-[(2S,3R,12bR)-3-ethenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
Basic Information
CAS
35467-43-7
Multi CAS
Yes
Molecular Formula
C22H26N2O3
Molecular Weight
366.500000
Exact Mass
366.194343
InChI
InChI=1S/C22H26N2O3/c1-4-14-12-24-10-9-16-15-7-5-6-8-19(15)23-21(16)20(24)11-17(14)18(13-26-2)22(25)27-3/h4-8,13-14,17,20,23H,1,9-12H2,2-3H3/b18-13+/t14-,17-,20+/m0/s1
InChIKey
TZUGIFAYWNNSAO-AZQGJTAVSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
9
Fraction Csp3
0.41
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
105.22
TPSA
54.56
LogP / Solubility
WLOGP
3.59
MLOGP
3.18
XLogP3
3.2
Consensus LogP
3.32
Log S (ESOL)
-4.36
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.5
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.4
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5
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