![CAS 86443-19-8 4-OXO-1,4-DIHYDRO-[1,10]PHENANTHROLINE-3-CARBOXYLIC ACID ETHYL ESTER molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/86443-19-8.gif)
CAS RN: 86443-19-8
4-OXO-1,4-DIHYDRO-[1,10]PHENANTHROLINE-3-CARBOXYLIC ACID ETHYL ESTER
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250606 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250825 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250730 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250111 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250705 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250219 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS86443-19-8
- Purity/Analytical Methods: >99.0%
86443-19-8 / ethyl 4-oxo-1H-1,10-phenanthroline-3-carboxylate
Basic Information
CAS
86443-19-8
Multi CAS
Yes
Molecular Formula
C15H12N2O3
Molecular Weight
268.270000
Exact Mass
268.084792
InChI
InChI=1S/C15H12N2O3/c1-2-20-15(19)11-8-17-13-10(14(11)18)6-5-9-4-3-7-16-12(9)13/h3-8H,2H2,1H3,(H,17,18)
InChIKey
YUPWGIFULUYTQG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
14
Fraction Csp3
0.13
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
75.83
TPSA
72.05
LogP / Solubility
WLOGP
2.25
MLOGP
1.99
XLogP3
2.3
Consensus LogP
2.18
Log S (ESOL)
-3.31
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.39
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.51
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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![CAS 86453-15-8 [(1,1-DIOXIDOTETRAHYDROTHIEN-3-YL)THIO]ACETIC ACID molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB3271502.gif)