CAS RN: 6259-68-3
4-Imino-5-hydroxy-8-amino-1(4H)-naphthalenone
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.20250824 | 250mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS6259-68-3
- Purity/Analytical Methods: >99.0%
6259-68-3 / 8-amino-5-hydroxy-4-iminonaphthalen-1-one
Basic Information
CAS
6259-68-3
Multi CAS
No
Molecular Formula
C10H8N2O2
Molecular Weight
188.180000
Exact Mass
188.058578
InChI
InChI=1S/C10H8N2O2/c11-5-1-3-7(13)10-6(12)2-4-8(14)9(5)10/h1-4,11,14H,12H2
InChIKey
DQRBQYWUILSPIG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
H-bond acceptors
4
H-bond donors
3
Molar refractivity
52.82
TPSA
87.17
LogP / Solubility
WLOGP
1.09
MLOGP
0.96
XLogP3
1.1
Consensus LogP
1.05
Log S (ESOL)
-2.01
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.89
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.79
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.09
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
