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CAS 39576-83-5 8-METHYL-2,4-DICHLOROQUINAZOLINE molecular structure lightbox
CAS RN: 39576-83-5

8-METHYL-2,4-DICHLOROQUINAZOLINE

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250121 1g In stock Inquiry
Batchno.20260131 250mg In stock Inquiry
Batchno.20250123 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
Batchno.20251011 5g In stock Inquiry
  • Product code: SSC-147267
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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, 5g
  • 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 39576-83-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Shanghai Inquiry
5g ≥97% 0 Out of Stock Beijing Inquiry

39576-83-5 / 2,4-dichloro-8-methylquinazoline

Standard CAS: 39576-83-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
39576-83-5
Multi CAS
No
Molecular Formula
C9H6CL2N2
Molecular Weight
213.060000
Exact Mass
211.990804
InChI
InChI=1S/C9H6Cl2N2/c1-5-3-2-4-6-7(5)12-9(11)13-8(6)10/h2-4H,1H3
InChIKey
XCIWNFKPROTKHB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
10
Fraction Csp3
0.11
H-bond acceptors
2
Molar refractivity
54.3
TPSA
25.78

LogP / Solubility

WLOGP
3.25
MLOGP
2.86
XLogP3
3.8
Consensus LogP
3.3
Log S (ESOL)
-3.77
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.65
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.74
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.72

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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