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CAS 396-02-1 2,4-DICHLORO-7-(TRIFLUOROMETHYL)QUINAZOLINE molecular structure lightbox
CAS RN: 396-02-1

2,4-DICHLORO-7-(TRIFLUOROMETHYL)QUINAZOLINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251214 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-147283
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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 396-02-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

396-02-1 / 2,4-dichloro-7-(trifluoromethyl)quinazoline

Standard CAS: 396-02-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
396-02-1
Multi CAS
No
Molecular Formula
C9H3CL2F3N2
Molecular Weight
267.030000
Exact Mass
265.962538
InChI
InChI=1S/C9H3Cl2F3N2/c10-7-5-2-1-4(9(12,13)14)3-6(5)15-8(11)16-7/h1-3H
InChIKey
PRJBXUBPUYNFQF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
10
Fraction Csp3
0.11
H-bond acceptors
2
Molar refractivity
54.56
TPSA
25.78

LogP / Solubility

WLOGP
3.96
MLOGP
3.49
XLogP3
4.3
Consensus LogP
3.92
Log S (ESOL)
-4.45
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.61
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.68
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.54

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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