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CAS 929809-29-0 1′-Isopropyl-3,5,6,7-tetrahydrospiro[imidazo-[4,5-c]pyridine-4,4′-piperidine] molecular structure lightbox
CAS RN: 929809-29-0

1′-Isopropyl-3,5,6,7-tetrahydrospiro[imidazo-[4,5-c]pyridine-4,4′-piperidine]

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250321 500mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS929809-29-0
  • Purity/Analytical Methods: >99.0%
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929809-29-0 / 1'-propan-2-ylspiro[1,5,6,7-tetrahydroimidazo[4,5-c]pyridine-4,4'-piperidine]

Standard CAS: 929809-29-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
929809-29-0
Multi CAS
No
Molecular Formula
C13H22N4
Molecular Weight
234.340000
Exact Mass
234.184447
InChI
InChI=1S/C13H22N4/c1-10(2)17-7-4-13(5-8-17)12-11(3-6-16-13)14-9-15-12/h9-10,16H,3-8H2,1-2H3,(H,14,15)
InChIKey
SQIJZWSMTZEZOQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
5
Fraction Csp3
0.77
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
67.92
TPSA
43.95

LogP / Solubility

WLOGP
1.25
MLOGP
1.11
XLogP3
0.7
Consensus LogP
1.02
Log S (ESOL)
-2.24
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.34
Class (SILICOS-IT)
Moderately 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)
-3.26

Drug-likeness / Medicinal Chemistry

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

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