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CAS 144217-65-2 N1-(2,2,6,6-tetraMethylpiperidin-4-yl)-N2-p-tolyloxalaMide molecular structure lightbox
CAS RN: 144217-65-2

N1-(2,2,6,6-tetraMethylpiperidin-4-yl)-N2-p-tolyloxalaMide

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Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250416 1mg / 5mg / 25mg / 100mg Confirm by inquiry Shanghai 5-7 business days Inquiry
  • Product code: starshine_CAS144217-65-2
  • Purity/Analytical Methods: >99.0%
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144217-65-2 / N'-(4-methylphenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide

Standard CAS: 144217-65-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
144217-65-2
Multi CAS
No
Molecular Formula
C18H27N3O2
Molecular Weight
317.400000
Exact Mass
317.210327
SMILES
CC1=CC=C(C=C1)NC(=O)C(=O)NC2CC(NC(C2)(C)C)(C)C
InChI
InChI=1S/C18H27N3O2/c1-12-6-8-13(9-7-12)19-15(22)16(23)20-14-10-17(2,3)21-18(4,5)11-14/h6-9,14,21H,10-11H2,1-5H3,(H,19,22)(H,20,23)
InChIKey
AYAGJQPDCPRMNG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
3
Molar refractivity
92.27
TPSA
70.23

LogP / Solubility

WLOGP
2.36
MLOGP
2.09
XLogP3
2.5
Consensus LogP
2.32
Log S (ESOL)
-3.36
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.87
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.92
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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