CAS RN: 397266-02-3
1,10-Phenanthroline-3,8-diol (9CI)
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.20250209 | 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS397266-02-3
- Purity/Analytical Methods: >99.0%
397266-02-3 / 8-hydroxy-10H-1,10-phenanthrolin-3-one
Basic Information
CAS
397266-02-3
Multi CAS
No
Molecular Formula
C12H8N2O2
Molecular Weight
212.200000
Exact Mass
212.058578
InChI
InChI=1S/C12H8N2O2/c15-9-3-7-1-2-8-4-10(16)6-14-12(8)11(7)13-5-9/h1-6,13,15H
InChIKey
AYTWISWDWSARJX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
14
H-bond acceptors
3
H-bond donors
2
Molar refractivity
61.53
TPSA
65.98
LogP / Solubility
WLOGP
1.78
MLOGP
1.57
XLogP3
-0.1
Consensus LogP
1.08
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.59
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)
-2.75
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
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