CAS RN: 1275582-97-2
ACX-362E
Product Availability
Choose a grade to view its available package options.
12 package records11 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250203 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260320 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260529 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20250101 | 1mg / 5mg | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250506 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250706 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250213 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1275582-97-2
- Purity/Analytical Methods: >99.0%
1275582-97-2 / 2-[(3,4-dichlorophenyl)methylamino]-7-(2-morpholin-4-ylethyl)-1H-purin-6-one
Basic Information
CAS
1275582-97-2
Multi CAS
No
Molecular Formula
C18H20Cl2N6O2
Molecular Weight
423.300000
Exact Mass
422.102479
SMILES
C1COCCN1CCN2C=NC3=C2C(=O)NC(=N3)NCC4=CC(=C(C=C4)Cl)Cl
InChI
InChI=1S/C18H20Cl2N6O2/c19-13-2-1-12(9-14(13)20)10-21-18-23-16-15(17(27)24-18)26(11-22-16)4-3-25-5-7-28-8-6-25/h1-2,9,11H,3-8,10H2,(H2,21,23,24,27)
InChIKey
DEGSGBKTODESHH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
15
Fraction Csp3
0.39
Rotatable bonds
6
H-bond acceptors
7
H-bond donors
2
Molar refractivity
109.2
TPSA
88.07
LogP / Solubility
WLOGP
2.37
MLOGP
2.11
XLogP3
1.6
Consensus LogP
2.03
Log S (ESOL)
-3.96
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.74
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.1
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.62
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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