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CAS 69584-91-4 1,2-DIHYDRO-1′-METHYLSPIRO[3H-INDOLE-3,4′-PIPERIDINE] molecular structure lightbox
CAS RN: 69584-91-4

1,2-DIHYDRO-1′-METHYLSPIRO[3H-INDOLE-3,4′-PIPERIDINE]

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5 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250512 100mg Out of stock Inquiry
Batchno.20260502 1g Out of stock Inquiry
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Batchno.20250422 25mg / 100mg Out of stock 8-10 business days Inquiry
Batchno.20250207 5g Out of stock Inquiry
  • Product code: starshine_CAS69584-91-4
  • Purity/Analytical Methods: >99.0%
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69584-91-4 / 1-methylspiro[2H-indole-3,4'-piperidine]

Standard CAS: 69584-91-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
69584-91-4
Multi CAS
Yes
Molecular Formula
C13H18N2
Molecular Weight
202.300000
Exact Mass
202.146999
InChI
InChI=1S/C13H18N2/c1-15-8-6-13(7-9-15)10-14-12-5-3-2-4-11(12)13/h2-5,14H,6-10H2,1H3
InChIKey
NPUZJRBPYOYUMS-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.54
H-bond acceptors
2
H-bond donors
1
Molar refractivity
63.49
TPSA
15.27

LogP / Solubility

WLOGP
1.76
MLOGP
1.55
XLogP3
1.9
Consensus LogP
1.74
Log S (ESOL)
-2.5
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.49
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.43
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)
-2.71

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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