CAS RN: 1116230-89-7
6-Methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
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.20260211 | 250mg | Out of stock | 15 business days | Inquiry |
- Product code: SSC-012245
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
1116230-89-7 / 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-amine | 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine | SCHEMBL2207810
Basic Information
CAS
1116230-89-7
Multi CAS
No
Molecular Formula
C11H16N2O
Molecular Weight
192.260000
Exact Mass
192.126263
SMILES
CN1CCC2=CC(=C(C=C2C1)N)OC
InChI
InChI=1S/C11H16N2O/c1-13-4-3-8-6-11(14-2)10(12)5-9(8)7-13/h5-6H,3-4,7,12H2,1-2H3
InChIKey
XRHYBSPANQDMJG-UHFFFAOYSA-N
Synonyms
6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-amine
6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
SCHEMBL2207810
XRHYBSPANQDMJG-UHFFFAOYSA-N
AT29984
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
57.44
TPSA
38.49
LogP / Solubility
WLOGP
1.27
MLOGP
1.11
XLogP3
1.1
Consensus LogP
1.16
Log S (ESOL)
-2.08
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.05
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.08
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.99
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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