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CAS 896213-29-9 Methyl 2-[4-(-2-PyriMidyl)-1-piperazinyl]acetate molecular structure lightbox
CAS RN: 896213-29-9

Methyl 2-[4-(-2-PyriMidyl)-1-piperazinyl]acetate

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251027 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-201652
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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: 1g, 5g, 0.25g, 0.1g
  • 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 896213-29-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 5 In Stock Beijing Inquiry
5g >95% 5 In Stock Hong Kong Inquiry
0.25g >95% 1 In Stock Shenzhen Inquiry
0.1g >95% 0 Out of Stock Hong Kong Inquiry

896213-29-9 / methyl 2-(4-pyrimidin-2-ylpiperazin-1-yl)acetate

Standard CAS: 896213-29-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
896213-29-9
Multi CAS
No
Molecular Formula
C11H16N4O2
Molecular Weight
236.270000
Exact Mass
236.127326
InChI
InChI=1S/C11H16N4O2/c1-17-10(16)9-14-5-7-15(8-6-14)11-12-3-2-4-13-11/h2-4H,5-9H2,1H3
InChIKey
LKIKANDKOLNBGH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.55
Rotatable bonds
3
H-bond acceptors
6
Molar refractivity
62.7
TPSA
58.56

LogP / Solubility

WLOGP
-0.23
MLOGP
-0.2
XLogP3
0.4
Consensus LogP
-0.01
Log S (ESOL)
-1.22
Class (ESOL)
Soluble
Log S (Ali)
-1.33
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.37
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)
-4.32

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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