CAS RN: 24886-73-5
1-AZIDOADAMANTANE 97
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260220 | 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS24886-73-5
- Purity/Analytical Methods: >99.0%
24886-73-5 / 1-azidoadamantane
Basic Information
CAS
24886-73-5
Multi CAS
No
Molecular Formula
C10H15N3
Molecular Weight
177.250000
Exact Mass
177.126597
SMILES
C1C2CC3CC1CC(C2)(C3)N=[N+]=[N-]
InChI
InChI=1S/C10H15N3/c11-13-12-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2
InChIKey
JOMZSYXWYOVFEE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
50.05
TPSA
48.76
LogP / Solubility
WLOGP
3.27
MLOGP
2.87
XLogP3
3.8
Consensus LogP
3.31
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.37
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.64
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)
-1.48
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6
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