CAS RN: 792927-06-1

1-[(4-methoxyphenyl)sulfonyl]-4′-methyl-4,1′-bipiperidine

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Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251209 100mg In stock Shanghai Inquiry
Batchno.20251116 10mg In stock Shanghai Inquiry
Batchno.20250505 25mg In stock Shanghai Inquiry
Batchno.20250519 5mg In stock Shanghai Inquiry
Batchno.20251109 5mg / 25mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS792927-06-1
  • Purity/Analytical Methods: >99.0%
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792927-06-1 / 1-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-methylpiperidine

Standard CAS: 792927-06-1 Multi CAS: Yes

Basic Information

CAS
792927-06-1
Multi CAS
Yes
Molecular Formula
C18H28N2O3S
Molecular Weight
352.500000
Exact Mass
352.182064
InChI
InChI=1S/C18H28N2O3S/c1-15-7-11-19(12-8-15)16-9-13-20(14-10-16)24(21,22)18-5-3-17(23-2)4-6-18/h3-6,15-16H,7-14H2,1-2H3
InChIKey
XCBHYDPDIJQQGM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
6
Fraction Csp3
0.67
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
94.75
TPSA
49.85

LogP / Solubility

WLOGP
2.58
MLOGP
2.29
XLogP3
2.9
Consensus LogP
2.59
Log S (ESOL)
-3.57
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.57
Class (SILICOS-IT)
Slightly 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
Yes
Log Kp (skin permeation)
-3.04

Drug-likeness / Medicinal Chemistry

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

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