CAS RN: 763111-47-3
4-(4-fluoro-3-(piperazine-1-carbonyl)benzyl)phthalazin-1(2H)-one
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.20260103 | 100g | In stock | Wuhan | Inquiry |
| Batchno.20260605 | 10g | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20250809 | 1g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20260107 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250115 | 25g | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20250716 | 500g | In stock | Shanghai | Inquiry |
| Batchno.20250524 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: SSC-185753
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 10g, 5g, 25g, 100g, 0.25g, 1g
- Available purity: >97%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 10g | >97% | 2 In Stock | Hong Kong | Inquiry |
| 5g | >97% | 1 In Stock | Hong Kong | Inquiry |
| 25g | >97% | 1 In Stock | Shanghai | Inquiry |
| 100g | >97% | 1 In Stock | Hong Kong | Inquiry |
| 0.25g | >97% | 0 Out of Stock | Shanghai | Inquiry |
| 1g | >97% | 0 Out of Stock | Beijing | Inquiry |
763111-47-3 / 4-[[4-fluoro-3-(piperazine-1-carbonyl)phenyl]methyl]-2H-phthalazin-1-one
Basic Information
CAS
763111-47-3
Multi CAS
Yes
Molecular Formula
C20FH19N4O2
Molecular Weight
366.400000
Exact Mass
366.149204
InChI
InChI=1S/C20H19FN4O2/c21-17-6-5-13(11-16(17)20(27)25-9-7-22-8-10-25)12-18-14-3-1-2-4-15(14)19(26)24-23-18/h1-6,11,22H,7-10,12H2,(H,24,26)
InChIKey
MFFUYEOGICAKCK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
16
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
100.34
TPSA
78.09
LogP / Solubility
WLOGP
1.7
MLOGP
1.51
XLogP3
1.5
Consensus LogP
1.57
Log S (ESOL)
-3.42
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.79
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.81
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.75
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
-
tert-butyl 4-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)Methyl)benzoyl)piperazine-1-carboxylate
- CAS RN: 763114-04-1
- Product Code: starshine_CAS763114-04-1
- Purity/Analytical method: >99.0%
-
2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile
- CAS RN: 763114-25-6
- Product Code: SSC-185755
-
2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)Methyl)benzoic acid
- CAS RN: 763114-26-7
- Product Code: SSC-185756
-
3-nonylthieno[3,2-b]thiophene
- CAS RN: 763114-94-9
- Product Code: starshine_CAS763114-94-9
- Purity/Analytical method: >99.0%
-
![CAS 763114-25-6 2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/763114-25-6.gif)
![CAS 763114-94-9 3-nonylthieno[3,2-b]thiophene molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/763114-94-9.gif)
