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CAS 1984825-25-3 (S)-4-(TERT-BUTOXYCARBONYL)-4-AZASPIRO[2.4]HEPTANE-5-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 1984825-25-3

(S)-4-(TERT-BUTOXYCARBONYL)-4-AZASPIRO[2.4]HEPTANE-5-CARBOXYLIC ACID

Product Availability

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7 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityInquiry
Batchno.20250905 100mg In stock Inquiry
Batchno.20250418 1g Out of stock Inquiry
Batchno.20251231 250mg Out of stock Inquiry
Batchno.20260423 25mg Out of stock Inquiry
Batchno.20251121 500mg Out of stock Inquiry
Batch No.PackageAvailabilityInquiry
Batchno.20260408 100mg Out of stock Inquiry
Batchno.20250427 250mg Out of stock Inquiry
  • Product code: SSC-093528
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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
  • Available purity: >95%
  • Inventory rows with stock: 3
  • 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 1984825-25-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 5 In Stock Beijing Inquiry
0.25g >95% 1 In Stock Shanghai Inquiry
1g >95% 1 In Stock Hong Kong Inquiry

1984825-25-3 / (5S)-4-[(2-methylpropan-2-yl)oxycarbonyl]-4-azaspiro[2.4]heptane-5-carboxylic acid

Standard CAS: 1984825-25-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1984825-25-3
Multi CAS
No
Molecular Formula
C12H19NO4
Molecular Weight
241.280000
Exact Mass
241.131408
SMILES
CC(C)(C)OC(=O)N1[C@@H](CCC12CC2)C(=O)O
InChI
InChI=1S/C12H19NO4/c1-11(2,3)17-10(16)13-8(9(14)15)4-5-12(13)6-7-12/h8H,4-7H2,1-3H3,(H,14,15)/t8-/m0/s1
InChIKey
SXXIDOHJYDGJJV-QMMMGPOBSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.83
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
60.7
TPSA
66.84

LogP / Solubility

WLOGP
2
MLOGP
1.77
XLogP3
1.6
Consensus LogP
1.79
Log S (ESOL)
-2.53
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.98
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.01
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)
-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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