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CAS 56287-73-1 2-(fluoromethyl)-6-nitro-3-o-tolylquinazolin-4(3H)-one molecular structure lightbox
CAS RN: 56287-73-1

2-(fluoromethyl)-6-nitro-3-o-tolylquinazolin-4(3H)-one

Product Availability

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5 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260424 1g Out of stock Inquiry
Batchno.20250131 250mg Out of stock Inquiry
Batchno.20250304 250mg / 1g / 5g / 10g Confirm by inquiry Shanghai Inquiry
Batchno.20250911 25g Out of stock Inquiry
Batchno.20260629 5g Out of stock Inquiry
  • Product code: SSC-164270
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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 56287-73-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

56287-73-1 / 2-(fluoromethyl)-3-(2-methylphenyl)-6-nitroquinazolin-4-one

Standard CAS: 56287-73-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
56287-73-1
Multi CAS
No
Molecular Formula
C16FH12N3O3
Molecular Weight
313.280000
Exact Mass
313.086269
InChI
InChI=1S/C16H12FN3O3/c1-10-4-2-3-5-14(10)19-15(9-17)18-13-7-6-11(20(22)23)8-12(13)16(19)21/h2-8H,9H2,1H3
InChIKey
YLWBZTIVGRUKCL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
16
Fraction Csp3
0.12
Rotatable bonds
3
H-bond acceptors
5
Molar refractivity
83.54
TPSA
78.03

LogP / Solubility

WLOGP
3.07
MLOGP
2.72
XLogP3
2.7
Consensus LogP
2.83
Log S (ESOL)
-4.03
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.35
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.61
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.45

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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