CAS RN: 71878-19-8

Chimassorb 944

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3 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260524 100g Out of stock Inquiry
Batchno.20251211 500g Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250214 100g / 500g / 2.5kg Confirm by inquiry Shanghai, Shandong 8-10 business days Inquiry
  • Product code: starshine_CAS71878-19-8
  • Purity/Analytical Methods: >99.0%
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71878-19-8 / N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;2,4,6-trichloro-1,3,5-triazine;2,4,4-trimethylpentan-2-amine

Standard CAS: 71878-19-8 Multi CAS: Yes

Basic Information

CAS
71878-19-8
Multi CAS
Yes
Molecular Formula
C35H69CL3N8
Molecular Weight
708.300000
Exact Mass
706.471077
InChI
InChI=1S/C24H50N4.C8H19N.C3Cl3N3/c1-21(2)15-19(16-22(3,4)27-21)25-13-11-9-10-12-14-26-20-17-23(5,6)28-24(7,8)18-20;1-7(2,3)6-8(4,5)9;4-1-7-2(5)9-3(6)8-1/h19-20,25-28H,9-18H2,1-8H3;6,9H2,1-5H3;
InChIKey
ORECYURYFJYPKY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
46
Aromatic heavy atom count
6
Fraction Csp3
0.91
Rotatable bonds
10
H-bond acceptors
8
H-bond donors
5
Molar refractivity
200.3
TPSA
112.81

LogP / Solubility

WLOGP
8.34
MLOGP
7.4
XLogP3
8.34
Consensus LogP
8.03
Log S (ESOL)
-8.92
Class (ESOL)
Insoluble
Log S (Ali)
-11.39
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.38
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.12

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

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