CAS RN: 878287-56-0
8-(2-fluorophenyl)-9H-purine
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.20250223 | 50mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS878287-56-0
- Purity/Analytical Methods: >99.0%
878287-56-0 / 8-(2-fluorophenyl)-7H-purine
Basic Information
CAS
878287-56-0
Multi CAS
No
Molecular Formula
C11FH7N4
Molecular Weight
214.200000
Exact Mass
214.065474
InChI
InChI=1S/C11H7FN4/c12-8-4-2-1-3-7(8)10-15-9-5-13-6-14-11(9)16-10/h1-6H,(H,13,14,15,16)
InChIKey
WSJXIFBIXREODX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
57.08
TPSA
54.46
LogP / Solubility
WLOGP
2.16
MLOGP
1.9
XLogP3
1.5
Consensus LogP
1.85
Log S (ESOL)
-3.16
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.88
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.96
Class (SILICOS-IT)
Moderately 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)
-2.49
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
8-(2,3-difluorophenyl)-9H-purine
- CAS RN: 878287-57-1
- Product Code: starshine_CAS878287-57-1
- Purity/Analytical method: >99.0%
-
L-Phenylalanine-13C9,15N
- CAS RN: 878339-23-2
- Product Code: starshine_CAS878339-23-2
- Purity/Analytical method: >99.0%
-
methyl (2-amino-1,3-oxazol-5-yl)acetate
- CAS RN: 878375-87-2
- Product Code: starshine_CAS878375-87-2
- Purity/Analytical method: >99.0%
-
tert-butyl 5-(aMinoMethyl)thiazol-2-ylcarbaMate
- CAS RN: 878376-13-7
- Product Code: SSC-198164
-
(S)-2-Amino-3-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-propionic acid
- CAS RN: 878384-69-1
- Product Code: starshine_CAS878384-69-1
- Purity/Analytical method: >99.0%
-
![CAS 878384-69-1 (S)-2-Amino-3-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-propionic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/878384-69-1.gif)
