![CAS 1335299-39-2 2-(4-Fluorophenyl)imidazo[1,2-a]pyrimidin-7-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1335299-39-2.gif)
CAS RN: 1335299-39-2
2-(4-Fluorophenyl)imidazo[1,2-a]pyrimidin-7-amine
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.20260203 | 100mg / 250mg / 1g / 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1335299-39-2
- Purity/Analytical Methods: >99.0%
1335299-39-2 / 2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-7-amine
Basic Information
CAS
1335299-39-2
Multi CAS
No
Molecular Formula
C12H9FN4
Molecular Weight
228.220000
Exact Mass
228.081124
SMILES
C1=CC(=CC=C1C2=CN3C=CC(=NC3=N2)N)F
InChI
InChI=1S/C12H9FN4/c13-9-3-1-8(2-4-9)10-7-17-6-5-11(14)16-12(17)15-10/h1-7H,(H2,14,15,16)
InChIKey
DAHLOBWNOWKEOX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
62.79
TPSA
56.21
LogP / Solubility
WLOGP
2.12
MLOGP
1.87
XLogP3
2.5
Consensus LogP
2.16
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.96
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.02
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)
-2.61
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
-
(2S,5S)-1-((methoxycarbonyl)-L-valyl)-5-methylpyrrolidine-2-carboxylic acid
- CAS RN: 1335316-40-9
- Product Code: starshine_CAS1335316-40-9
- Purity/Analytical method: >99.0%
-
Ethyl-d5 Vanillin
- CAS RN: 1335401-74-5
- Product Code: starshine_CAS1335401-74-5
- Purity/Analytical method: >99.0%
-
-
-
(S)-1-(Benzo[d][1,3]dioxol-5-yl)butan-1-amine hydrochloride
- CAS RN: 1335729-51-5
- Product Code: starshine_CAS1335729-51-5
- Purity/Analytical method: >99.0%
-
![CAS 1335729-51-5 (S)-1-(Benzo[d][1,3]dioxol-5-yl)butan-1-amine hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1335729-51-5.gif)
