CAS RN: 328541-79-3
(NAPHTHALEN-2-YLAMINO)-ACETIC ACID (3,5-DIBROMO-2,4-DIHYDROXY-BENZYLIDENE)-HYDRAZIDE
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250315 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250908 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20251031 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20260306 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260619 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260325 | 2mg | In stock | Shanghai | Inquiry |
| Batchno.20251124 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260220 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS328541-79-3
- Purity/Analytical Methods: >99.0%
328541-79-3 / N-[(E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylideneamino]-2-(naphthalen-2-ylamino)acetamide
Basic Information
CAS
328541-79-3
Multi CAS
Yes
Molecular Formula
C19H15BR2N3O3
Molecular Weight
493.100000
Exact Mass
492.945970
InChI
InChI=1S/C19H15Br2N3O3/c20-15-8-13(18(26)17(21)19(15)27)9-23-24-16(25)10-22-14-6-5-11-3-1-2-4-12(11)7-14/h1-9,22,26-27H,10H2,(H,24,25)/b23-9+
InChIKey
RMBDLOATEPYBSI-NUGSKGIGSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
16
Fraction Csp3
0.05
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
4
Molar refractivity
113.35
TPSA
93.95
LogP / Solubility
WLOGP
4.34
MLOGP
3.85
XLogP3
4.8
Consensus LogP
4.33
Log S (ESOL)
-5.74
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.74
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.07
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.65
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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