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CAS 67305-45-7 methyl 2-(6-bromo-4-oxoquinazolin-3(4H)-yl)acetate molecular structure lightbox
CAS RN: 67305-45-7

methyl 2-(6-bromo-4-oxoquinazolin-3(4H)-yl)acetate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250124 100mg / 250mg / 500mg Out of stock 1 business days Inquiry
  • Product code: SSC-177017
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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 67305-45-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

67305-45-7 / methyl 2-(6-bromo-4-oxoquinazolin-3-yl)acetate

Standard CAS: 67305-45-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
67305-45-7
Multi CAS
No
Molecular Formula
BC11H9O3Rn2
Molecular Weight
297.100000
Exact Mass
295.979650
InChI
InChI=1S/C11H9BrN2O3/c1-17-10(15)5-14-6-13-9-3-2-7(12)4-8(9)11(14)16/h2-4,6H,5H2,1H3
InChIKey
GVYDYMQWYJPXEK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
10
Fraction Csp3
0.18
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
65.72
TPSA
61.19

LogP / Solubility

WLOGP
1.33
MLOGP
1.18
XLogP3
1.5
Consensus LogP
1.34
Log S (ESOL)
-2.82
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.96
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.94
Class (SILICOS-IT)
Moderately 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)
-3.59

Drug-likeness / Medicinal Chemistry

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

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