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CAS 612501-52-7 4-(3-Chloro-2-fluoroanilino)-6-hydroxy-7- methoxyquinazoline molecular structure lightbox
CAS RN: 612501-52-7

4-(3-Chloro-2-fluoroanilino)-6-hydroxy-7- methoxyquinazoline

Product Availability

Choose a grade to view its available package options.

6 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250708 10g In stock Shanghai Inquiry
Batchno.20251119 1g In stock Shanghai Inquiry
Batchno.20260604 250mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250618 250mg / 1g / 5g / 10g / 25g Out of stock 5-7 business days Inquiry
Batchno.20250809 25g Out of stock Inquiry
Batchno.20250508 5g In stock Shanghai Inquiry
  • Product code: SSC-170027
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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 612501-52-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

612501-52-7 / 4-(3-chloro-2-fluoroanilino)-7-methoxyquinazolin-6-ol

Standard CAS: 612501-52-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
612501-52-7
Multi CAS
No
Molecular Formula
C15H11CLFN3O2
Molecular Weight
319.720000
Exact Mass
319.052383
InChI
InChI=1S/C15H11ClFN3O2/c1-22-13-6-11-8(5-12(13)21)15(19-7-18-11)20-10-4-2-3-9(16)14(10)17/h2-7,21H,1H3,(H,18,19,20)
InChIKey
VZBZUFGPXJGXNJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
16
Fraction Csp3
0.07
Rotatable bonds
3
H-bond acceptors
5
H-bond donors
2
Molar refractivity
82.45
TPSA
67.27

LogP / Solubility

WLOGP
3.88
MLOGP
3.43
XLogP3
3.8
Consensus LogP
3.7
Log S (ESOL)
-4.61
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.98
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.32
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.92

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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