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CAS 1160247-18-6 1-Oxa-7-azaspiro[4.5]decane-7-carboxylic acid, 3-(aMinoMethyl)-, 1,1-diMethylethyl ester molecular structure lightbox
CAS RN: 1160247-18-6

1-Oxa-7-azaspiro[4.5]decane-7-carboxylic acid, 3-(aMinoMethyl)-, 1,1-diMethylethyl ester

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260526 100mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-016084
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1160247-18-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

1160247-18-6 / tert-butyl 3-(aminomethyl)-1-oxa-9-azaspiro[4.5]decane-9-carboxylate

TERT-BUTYL 3-(AMINOMETHYL)-1-OXA-7-AZASPIRO[4.5]DECANE-7-CARBOXYLATE | MFCD12198562 | tert-butyl 3-(aminomethyl)-1-oxa-9-azaspiro[4.5]decane-9-carboxylate

Standard CAS: 1160247-18-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1160247-18-6
Multi CAS
Yes
Molecular Formula
C14H26N2O3
Molecular Weight
270.370000
Exact Mass
270.194343
SMILES
CC(C)(C)OC(=O)N1CCCC2(C1)CC(CO2)CN
InChI
InChI=1S/C14H26N2O3/c1-13(2,3)19-12(17)16-6-4-5-14(10-16)7-11(8-15)9-18-14/h11H,4-10,15H2,1-3H3
InChIKey
CYIJGWKOFZHWLD-UHFFFAOYSA-N
Synonyms
TERT-BUTYL 3-(AMINOMETHYL)-1-OXA-7-AZASPIRO[4.5]DECANE-7-CARBOXYLATE MFCD12198562 tert-butyl 3-(aminomethyl)-1-oxa-9-azaspiro[4.5]decane-9-carboxylate 1-OXA-7-AZASPIRO[4.5]DECANE-7-CARBOXYLIC ACID, 3-(AMINOMETHYL)-, 1,1-DIMETHYLETHYL ESTER tert-Butyl3-(aminomethyl)-1-oxa-7-azaspiro[4.5]decane-7-carboxylate

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
0.93
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
72.89
TPSA
64.79

LogP / Solubility

WLOGP
1.75
MLOGP
1.55
XLogP3
0.8
Consensus LogP
1.37
Log S (ESOL)
-2.55
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.04
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.99
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)
-3.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3.5

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