CAS RN: 2109805-87-8
FEN1 Inhibitor C3
Product Availability
Choose a grade to view its available package options.
7 package records7 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250703 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260514 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20260109 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250221 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250202 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260608 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250520 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS2109805-87-8
- Purity/Analytical Methods: >99.0%
2109805-87-8 / 3-hydroxy-1-(4-methoxyphenyl)quinazoline-2,4-dione
Basic Information
CAS
2109805-87-8
Multi CAS
No
Molecular Formula
C15H12N2O4
Molecular Weight
284.270000
Exact Mass
284.079707
SMILES
COC1=CC=C(C=C1)N2C3=CC=CC=C3C(=O)N(C2=O)O
InChI
InChI=1S/C15H12N2O4/c1-21-11-8-6-10(7-9-11)16-13-5-3-2-4-12(13)14(18)17(20)15(16)19/h2-9,20H,1H3
InChIKey
BBJIIPZSHQTBLW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
16
Fraction Csp3
0.07
Rotatable bonds
2
H-bond acceptors
6
H-bond donors
1
Molar refractivity
77.54
TPSA
73.46
LogP / Solubility
WLOGP
1.4
MLOGP
1.24
XLogP3
1.8
Consensus LogP
1.48
Log S (ESOL)
-2.92
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.9
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.91
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.46
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
2.5
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