CAS RN: 608140-12-1

N-METHYL-N-PROPYLPIPERIDINIUM BIS(TRIFLUOROMETHANESULFONYL)IMIDE

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7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260304 100g In stock Shanghai Inquiry
Batchno.20260321 10g In stock Shanghai Inquiry
Batchno.20250123 1g In stock Shanghai Inquiry
Batchno.20251002 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250717 25g In stock Shanghai Inquiry
Batchno.20250624 5g In stock Shanghai, Shenzhen Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251202 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong, Guangdong Inquiry
  • Product code: starshine_CAS608140-12-1
  • Purity/Analytical Methods: >99.0%
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608140-12-1 / bis(trifluoromethylsulfonyl)azanide;1-methyl-1-propylpiperidin-1-ium

Standard CAS: 608140-12-1 Multi CAS: No

Basic Information

CAS
608140-12-1
Multi CAS
No
Molecular Formula
C11F6H20N2O4S2
Molecular Weight
422.400000
Exact Mass
422.076868
InChI
InChI=1S/C9H20N.C2F6NO4S2/c1-3-7-10(2)8-5-4-6-9-10;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h3-9H2,1-2H3;/q+1;-1
InChIKey
IEFUHGXOQSVRDQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
78.24
TPSA
82.38

LogP / Solubility

WLOGP
3.09
MLOGP
2.74
XLogP3
3.09
Consensus LogP
2.97
Log S (ESOL)
-4.14
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.25
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.45
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.11

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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