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CAS RN: 1353636-82-4
3-Amino-3-(4-methoxyphenyl)cyclobutan-1-ol
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251123 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20251114 | 1g | In stock | Shenzhen | Inquiry | |
| Batchno.20260409 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250314 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250702 | 50mg / 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1353636-82-4
- Purity/Analytical Methods: >99.0%
1353636-82-4 / 3-amino-3-(4-methoxyphenyl)cyclobutan-1-ol
Basic Information
CAS
1353636-82-4
Multi CAS
No
Molecular Formula
C11H15NO2
Molecular Weight
193.240000
Exact Mass
193.110279
SMILES
COC1=CC=C(C=C1)C2(CC(C2)O)N
InChI
InChI=1S/C11H15NO2/c1-14-10-4-2-8(3-5-10)11(12)6-9(13)7-11/h2-5,9,13H,6-7,12H2,1H3
InChIKey
TYBCCVMYRJUCOA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
54.1
TPSA
55.48
LogP / Solubility
WLOGP
1
MLOGP
0.88
XLogP3
0.5
Consensus LogP
0.79
Log S (ESOL)
-1.86
Class (ESOL)
Soluble
Log S (Ali)
-1.87
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.99
Class (SILICOS-IT)
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)
-3.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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