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CAS 1159826-64-8 2,8-diazaspiro[4.5]decane hydrochloride molecular structure lightbox
CAS RN: 1159826-64-8

2,8-diazaspiro[4.5]decane hydrochloride

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250315 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1159826-64-8
  • Purity/Analytical Methods: >99.0%
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1159826-64-8 / 2,8-diazaspiro[4.5]decane;dihydrochloride

2,8-diazaspiro[4.5]decane hydrochloride | 2,8-diazaspiro[4.5]decane;hydrochloride | MFCD22576120

Standard CAS: 1159826-64-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1159826-64-8
Multi CAS
Yes
Molecular Formula
C8H18Cl2N2
Molecular Weight
213.150000
Exact Mass
212.084704
SMILES
C1CNCCC12CCNC2.Cl.Cl
InChI
InChI=1S/C8H16N2.2ClH/c1-4-9-5-2-8(1)3-6-10-7-8;;/h9-10H,1-7H2;2*1H
InChIKey
UVUVCHKSESBHCK-UHFFFAOYSA-N
Synonyms
2,8-diazaspiro[4.5]decane hydrochloride 2,8-diazaspiro[4.5]decane;hydrochloride MFCD22576120 DTXSID30726241 2,8-Diazaspiro[4.5]decane diHCl

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
56.52
TPSA
24.06

LogP / Solubility

WLOGP
1.19
MLOGP
1.05
XLogP3
1.19
Consensus LogP
1.14
Log S (ESOL)
-1.91
Class (ESOL)
Soluble
Log S (Ali)
-2.17
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.04
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)
-3.17

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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