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CAS 325290-50-4 tert-butyl 4-(azidomethyl)piperidine-1-carboxylate(SALTDATA: FREE) molecular structure lightbox
CAS RN: 325290-50-4

tert-butyl 4-(azidomethyl)piperidine-1-carboxylate(SALTDATA: FREE)

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3 package records0 with current stock1 grade group
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Batchno.20250430 1g Out of stock Inquiry
Batchno.20260111 250mg Out of stock Inquiry
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  • Product code: starshine_CAS325290-50-4
  • Purity/Analytical Methods: >99.0%
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325290-50-4 / tert-butyl 4-(azidomethyl)piperidine-1-carboxylate

Standard CAS: 325290-50-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
325290-50-4
Multi CAS
No
Molecular Formula
C11H20N4O2
Molecular Weight
240.300000
Exact Mass
240.158626
InChI
InChI=1S/C11H20N4O2/c1-11(2,3)17-10(16)15-6-4-9(5-7-15)8-13-14-12/h9H,4-8H2,1-3H3
InChIKey
BFPSPDBWZJTTOQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.91
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
64.54
TPSA
78.3

LogP / Solubility

WLOGP
2.94
MLOGP
2.6
XLogP3
2.8
Consensus LogP
2.78
Log S (ESOL)
-3.05
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.66
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.91
Class (SILICOS-IT)
Poorly 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)
-2.1

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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