[email protected]
CAS 896103-70-1 8-Boc-2-hydroxy-1-oxa-8-azaspiro[4.5]decane molecular structure lightbox
CAS RN: 896103-70-1

8-Boc-2-hydroxy-1-oxa-8-azaspiro[4.5]decane

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260331 100mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS896103-70-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

896103-70-1 / tert-butyl 2-hydroxy-1-oxa-8-azaspiro[4.5]decane-8-carboxylate

Standard CAS: 896103-70-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
896103-70-1
Multi CAS
Yes
Molecular Formula
C13H23NO4
Molecular Weight
257.330000
Exact Mass
257.162708
InChI
InChI=1S/C13H23NO4/c1-12(2,3)18-11(16)14-8-6-13(7-9-14)5-4-10(15)17-13/h10,15H,4-9H2,1-3H3
InChIKey
MTLANSXDLMFWGB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
0.92
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
66.1
TPSA
59

LogP / Solubility

WLOGP
1.88
MLOGP
1.67
XLogP3
1.3
Consensus LogP
1.62
Log S (ESOL)
-2.62
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.03
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.9
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.95

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3

Customers Also Viewed

Get In Touch

Contact Us