CAS RN: 410544-56-8
5-BROMO-N-(4-FLUOROBENZYL)-8-HYDROXY-1,6-NAPHTHYRIDINE-7-CARBOXAMIDE(WXG02578)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250604 | 25mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS410544-56-8
- Purity/Analytical Methods: >99.0%
410544-56-8 / 5-bromo-N-[(4-fluorophenyl)methyl]-8-hydroxy-1,6-naphthyridine-7-carboxamide
Basic Information
CAS
410544-56-8
Multi CAS
No
Molecular Formula
BC16H11N3O2Rf
Molecular Weight
376.180000
Exact Mass
375.001870
InChI
InChI=1S/C16H11BrFN3O2/c17-15-11-2-1-7-19-12(11)14(22)13(21-15)16(23)20-8-9-3-5-10(18)6-4-9/h1-7,22H,8H2,(H,20,23)
InChIKey
VRVGOUHPADQNHC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
16
Fraction Csp3
0.06
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
86.47
TPSA
75.11
LogP / Solubility
WLOGP
3.17
MLOGP
2.81
XLogP3
3.5
Consensus LogP
3.16
Log S (ESOL)
-4.48
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.93
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.09
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.77
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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