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CAS 2756333-93-2 2(1H)-Quinoxalinone, 7-(bromomethyl)-8-fluoro-3-methyl- molecular structure lightbox
CAS RN: 2756333-93-2

2(1H)-Quinoxalinone, 7-(bromomethyl)-8-fluoro-3-methyl-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250427 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-127153
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 10g, 25g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 2756333-93-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 3 In Stock Shanghai Inquiry
0.25g >95% 3 In Stock Beijing Inquiry
1g >95% 3 In Stock Shanghai Inquiry
10g >95% 2 In Stock Beijing Inquiry
25g >95% 2 In Stock Shenzhen Inquiry
5g >95% 1 In Stock Shenzhen Inquiry

2756333-93-2 / 7-(bromomethyl)-8-fluoro-3-methyl-1H-quinoxalin-2-one

Standard CAS: 2756333-93-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2756333-93-2
Multi CAS
No
Molecular Formula
C10H8BrFN2O
Molecular Weight
271.090000
Exact Mass
269.980400
SMILES
CC1=NC2=C(C(=C(C=C2)CBr)F)NC1=O
InChI
InChI=1S/C10H8BrFN2O/c1-5-10(15)14-9-7(13-5)3-2-6(4-11)8(9)12/h2-3H,4H2,1H3,(H,14,15)
InChIKey
OGVPZKIRXIFJEA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
59.69
TPSA
45.75

LogP / Solubility

WLOGP
2.27
MLOGP
2
XLogP3
1.4
Consensus LogP
1.89
Log S (ESOL)
-3.38
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.42
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.42
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)
-2.77

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

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