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CAS 926276-14-4 N,N-Dipropyl-9-oxo-bispidine molecular structure lightbox
CAS RN: 926276-14-4

N,N-Dipropyl-9-oxo-bispidine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251102 25mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS926276-14-4
  • Purity/Analytical Methods: >99.0%
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926276-14-4 / 3,7-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one

Standard CAS: 926276-14-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
926276-14-4
Multi CAS
Yes
Molecular Formula
C13H24N2O
Molecular Weight
224.340000
Exact Mass
224.188863
InChI
InChI=1S/C13H24N2O/c1-3-5-14-7-11-9-15(6-4-2)10-12(8-14)13(11)16/h11-12H,3-10H2,1-2H3
InChIKey
OMFLPCGPRUWPBC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.92
Rotatable bonds
4
H-bond acceptors
3
Molar refractivity
65.45
TPSA
23.55

LogP / Solubility

WLOGP
1.24
MLOGP
1.09
XLogP3
1.4
Consensus LogP
1.24
Log S (ESOL)
-1.75
Class (ESOL)
Soluble
Log S (Ali)
-2.29
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.63
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)
-3.21

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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