[email protected]
CAS 105276-96-8 5-Bromo-1H-[1,6]naphthyridin-2-one molecular structure lightbox
CAS RN: 105276-96-8

5-Bromo-1H-[1,6]naphthyridin-2-one

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250829 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-007034
GET A QUOTE
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
Request Bulk Quote

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 105276-96-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

105276-96-8 / 5-bromo-1H-1,6-naphthyridin-2-one

5-BROMO-1,6-NAPHTHYRIDIN-2(1H)-ONE | 5-Bromo-1H-[1,6]naphthyridin-2-one | 5-bromo-1H-1,6-naphthyridin-2-one

Standard CAS: 105276-96-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
105276-96-8
Multi CAS
Yes
Molecular Formula
C8H5BrN2O
Molecular Weight
225.040000
Exact Mass
223.958530
SMILES
C1=CC(=O)NC2=C1C(=NC=C2)Br
InChI
InChI=1S/C8H5BrN2O/c9-8-5-1-2-7(12)11-6(5)3-4-10-8/h1-4H,(H,11,12)
InChIKey
HBOWEWFBGYLXNY-UHFFFAOYSA-N
Synonyms
5-BROMO-1,6-NAPHTHYRIDIN-2(1H)-ONE 5-Bromo-1H-[1,6]naphthyridin-2-one 5-bromo-1H-1,6-naphthyridin-2-one MFCD20278293 CHEMBL144190

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
10
H-bond acceptors
2
H-bond donors
1
Molar refractivity
50.06
TPSA
45.75

LogP / Solubility

WLOGP
1.69
MLOGP
1.49
XLogP3
1.3
Consensus LogP
1.49
Log S (ESOL)
-2.91
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.62
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.52
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.9

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us