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CAS 1446507-37-4 6-(6-chloropyridin-2-yl)-1,3,5-triazine-2,4(1H,3H)-dione molecular structure lightbox
CAS RN: 1446507-37-4

6-(6-chloropyridin-2-yl)-1,3,5-triazine-2,4(1H,3H)-dione

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250425 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-055910
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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: ≥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 1446507-37-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1446507-37-4 / 6-(6-chloro-2-pyridinyl)-1H-1,3,5-triazine-2,4-dione

Standard CAS: 1446507-37-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1446507-37-4
Multi CAS
No
Molecular Formula
C8H5ClN4O2
Molecular Weight
224.600000
Exact Mass
224.010103
SMILES
C1=CC(=NC(=C1)Cl)C2=NC(=O)NC(=O)N2
InChI
InChI=1S/C8H5ClN4O2/c9-5-3-1-2-4(10-5)6-11-7(14)13-8(15)12-6/h1-3H,(H2,11,12,13,14,15)
InChIKey
QIJLXYYNGZYYBE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
53.72
TPSA
91.5

LogP / Solubility

WLOGP
0.17
MLOGP
0.16
XLogP3
1
Consensus LogP
0.44
Log S (ESOL)
-1.87
Class (ESOL)
Soluble
Log S (Ali)
-1.53
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.38
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.97

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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