CAS RN: 1449390-12-8
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1 package records 0 with current stock 1 grade group
Grade
97% (1)
In stock only
Batch No. Package Availability Lead Time Inquiry
Batchno.20260323
250mg / 1g
Out of stock
5-7 business days Inquiry
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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: 1g
Available purity: ≥95%
Inventory rows with stock: 0
Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 1449390-12-8
Pack Size
Recorded Purity
Available Qty
Ship From
Inquiry
1g
≥95%
0
Out of Stock
Beijing
Inquiry
1449390-12-8 / (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Standard CAS: 1449390-12-8
Multi CAS: No
Basic Information
copy
CAS
1449390-12-8 copy
Multi CAS
No copy
Molecular Formula
C18H31NO10 copy
Molecular Weight
421.400000 copy
Exact Mass
421.194796 copy
SMILES
COCCOCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O copy
InChI
InChI=1S/C18H31NO10/c1-23-6-7-25-10-11-27-14-15-28-13-12-26-9-8-24-5-4-18(22)29-19-16(20)2-3-17(19)21/h2-15H2,1H3 copy
InChIKey
KIIPLYSZOISNAS-UHFFFAOYSA-N copy
Computed Properties
copy
Structural Parameters
Heavy atom count
29 copy
Fraction Csp3
0.83 copy
Rotatable bonds
19 copy
H-bond acceptors
10 copy
Molar refractivity
97.77 copy
TPSA
119.06 copy
LogP / Solubility
WLOGP
-0.29 copy
MLOGP
-0.23 copy
XLogP3
-1.7 copy
Consensus LogP
-0.74 copy
Log S (ESOL)
-1.02 copy
Class (ESOL)
Soluble copy
Log S (Ali)
-2.81 copy
Class (Ali)
Moderately soluble copy
Log S (SILICOS-IT)
-4.44 copy
Class (SILICOS-IT)
Slightly soluble copy
ADME
GI absorption
High copy
BBB permeant
No copy
P-gp substrate
No copy
CYP1A2 inhibitor
No copy
CYP2C19 inhibitor
No copy
CYP2C9 inhibitor
No copy
CYP2D6 inhibitor
No copy
CYP3A4 inhibitor
No copy
Log Kp (skin permeation)
-5.49 copy
Drug-likeness / Medicinal Chemistry
Lipinski
Yes copy
Ghose
Yes copy
Veber
No copy
Egan
Yes copy
Muegge
No copy
Bioavailability score
0.55 copy
Brenk alerts
1 copy
Leadlikeness
No copy
Synthetic Accessibility
2.5 copy