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CAS 22177-92-0 4-(6-Chloropyrimidin-4-yl)morpholine molecular structure lightbox
CAS RN: 22177-92-0

4-(6-Chloropyrimidin-4-yl)morpholine

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250928 1g In stock Shanghai Inquiry
Batchno.20250306 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250612 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
Batchno.20260518 5g In stock Shanghai Inquiry
  • Product code: SSC-106678
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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: 1g
  • Available purity: ＞97%
  • 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 22177-92-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

22177-92-0 / 4-(6-chloropyrimidin-4-yl)morpholine

Standard CAS: 22177-92-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22177-92-0
Multi CAS
No
Molecular Formula
C8H10ClN3O
Molecular Weight
199.640000
Exact Mass
199.051240
SMILES
C1COCCN1C2=CC(=NC=N2)Cl
InChI
InChI=1S/C8H10ClN3O/c9-7-5-8(11-6-10-7)12-1-3-13-4-2-12/h5-6H,1-4H2
InChIKey
CFOBQJWOZVMWBR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
50.07
TPSA
38.25

LogP / Solubility

WLOGP
0.97
MLOGP
0.85
XLogP3
1.2
Consensus LogP
1.01
Log S (ESOL)
-1.96
Class (ESOL)
Soluble
Log S (Ali)
-1.89
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.88
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)
-3.25

Drug-likeness / Medicinal Chemistry

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

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