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CAS RN: 1353955-14-2
6-(Piperidin-4-yloxy)-pyriMidin-4-ylaMine hydrochloride
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.20251215 | 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1353955-14-2
- Purity/Analytical Methods: >99.0%
1353955-14-2 / 6-piperidin-4-yloxypyrimidin-4-amine;hydrochloride
Basic Information
CAS
1353955-14-2
Multi CAS
No
Molecular Formula
C9H15ClN4O
Molecular Weight
230.690000
Exact Mass
230.093439
SMILES
C1CNCCC1OC2=NC=NC(=C2)N.Cl
InChI
InChI=1S/C9H14N4O.ClH/c10-8-5-9(13-6-12-8)14-7-1-3-11-4-2-7;/h5-7,11H,1-4H2,(H2,10,12,13);1H
InChIKey
CHONEWTXYWTPBQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
2
Molar refractivity
60.21
TPSA
73.06
LogP / Solubility
WLOGP
0.61
MLOGP
0.54
XLogP3
0.61
Consensus LogP
0.59
Log S (ESOL)
-1.82
Class (ESOL)
Soluble
Log S (Ali)
-1.89
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.91
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)
-3.69
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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