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CAS 236406-61-4 2,7-DIAZASPIRO[4.5]DECANE-7-CARBOXYLIC ACID T-BUTYL ESTER molecular structure lightbox
CAS RN: 236406-61-4

2,7-DIAZASPIRO[4.5]DECANE-7-CARBOXYLIC ACID T-BUTYL ESTER

Product Availability

Choose a grade to view its available package options.

9 package records8 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260116 1g In stock Inquiry
Batchno.20250226 250mg In stock Inquiry
Batchno.20250412 50mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250611 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250506 100mg In stock Shanghai Inquiry
Batchno.20250808 10g Out of stock Inquiry
Batchno.20260209 1g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250720 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20250216 5g In stock Shanghai, Shenzhen, Chengdu Inquiry
  • Product code: SSC-115069
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 236406-61-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 2 In Stock Shenzhen Inquiry
0.25g >95% 2 In Stock Beijing Inquiry
1g >95% 2 In Stock Shanghai Inquiry
5g >95% 2 In Stock Shenzhen Inquiry

236406-61-4 / tert-butyl 2,7-diazaspiro[4.5]decane-7-carboxylate

Standard CAS: 236406-61-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
236406-61-4
Multi CAS
No
Molecular Formula
C13H24N2O2
Molecular Weight
240.340000
Exact Mass
240.183778
SMILES
CC(C)(C)OC(=O)N1CCCC2(C1)CCNC2
InChI
InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-8-4-5-13(10-15)6-7-14-9-13/h14H,4-10H2,1-3H3
InChIKey
ISIJQEHRDSCQIU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.92
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
66.96
TPSA
41.57

LogP / Solubility

WLOGP
2
MLOGP
1.76
XLogP3
1.4
Consensus LogP
1.72
Log S (ESOL)
-2.59
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.97
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.88
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)
-2.77

Drug-likeness / Medicinal Chemistry

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

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