CAS RN: 634180-49-7
1,1′-Biisoquinoline, 1,1′,2,2′,3,3′,4,4′-octahydro-, (1R,1’R)-
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260124 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260504 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20251003 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250131 | 250mg | In stock | Shanghai, Chengdu | Inquiry | |
| Batchno.20251026 | 50mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS634180-49-7
- Purity/Analytical Methods: >99.0%
634180-49-7 / 1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2,3,4-tetrahydroisoquinoline
Basic Information
CAS
634180-49-7
Multi CAS
Yes
Molecular Formula
C18H20N2
Molecular Weight
264.400000
Exact Mass
264.162649
InChI
InChI=1S/C18H20N2/c1-3-7-15-13(5-1)9-11-19-17(15)18-16-8-4-2-6-14(16)10-12-20-18/h1-8,17-20H,9-12H2/t17-,18-/m1/s1
InChIKey
NDHNLLQPMVDMRO-QZTJIDSGSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
81.78
TPSA
24.06
LogP / Solubility
WLOGP
2.76
MLOGP
2.44
XLogP3
2.5
Consensus LogP
2.57
Log S (ESOL)
-3.6
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.72
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.79
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.37
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
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