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CAS 1382035-21-3 3 – (Boc-aMino)-pyrrolidin-3 – carboxylic acid Methyl ester molecular structure lightbox
CAS RN: 1382035-21-3

3 – (Boc-aMino)-pyrrolidin-3 – carboxylic acid Methyl ester

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250626 100mg In stock Shanghai Inquiry
Batchno.20250501 100mg / 250mg Out of stock 5-7 business days Inquiry
Batchno.20251120 1g In stock Shanghai Inquiry
Batchno.20260125 250mg In stock Shanghai Inquiry
  • Product code: SSC-048159
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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: 0.25g, 1g
  • 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 1382035-21-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

1382035-21-3 / methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-3-carboxylate

Standard CAS: 1382035-21-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1382035-21-3
Multi CAS
No
Molecular Formula
C11H20N2O4
Molecular Weight
244.290000
Exact Mass
244.142307
SMILES
CC(C)(C)OC(=O)NC1(CCNC1)C(=O)OC
InChI
InChI=1S/C11H20N2O4/c1-10(2,3)17-9(15)13-11(8(14)16-4)5-6-12-7-11/h12H,5-7H2,1-4H3,(H,13,15)
InChIKey
SVIYIZMTEPXBNX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.82
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
2
Molar refractivity
61.6
TPSA
76.66

LogP / Solubility

WLOGP
0.42
MLOGP
0.37
XLogP3
0.4
Consensus LogP
0.4
Log S (ESOL)
-1.48
Class (ESOL)
Soluble
Log S (Ali)
-1.86
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.83
Class (SILICOS-IT)
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)
-3.91

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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