CAS RN: 745066-18-6
2-piperazin-1-yl-5-(trifluoromethyl)pyrimidine
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.20260616 | 250mg / 1g / 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-183967
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
745066-18-6 / 2-piperazin-1-yl-5-(trifluoromethyl)pyrimidine
Basic Information
CAS
745066-18-6
Multi CAS
No
Molecular Formula
C9F3H11N4
Molecular Weight
232.210000
Exact Mass
232.093581
InChI
InChI=1S/C9H11F3N4/c10-9(11,12)7-5-14-8(15-6-7)16-3-1-13-2-4-16/h5-6,13H,1-4H2
InChIKey
AJPNCKCRSAVLLC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
52.12
TPSA
41.05
LogP / Solubility
WLOGP
0.9
MLOGP
0.8
XLogP3
0.9
Consensus LogP
0.87
Log S (ESOL)
-2.06
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.12
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.04
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)
-3.49
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
-
![CAS 745075-82-5 2-Chloro-4-methyl-5,6-dihydro-7H-cyclopenta[b]pyridin-7-one molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
2-Chloro-4-methyl-5,6-dihydro-7H-cyclopenta[b]pyridin-7-one
- CAS RN: 745075-82-5
- Product Code: SSC-183970
-
5-Thiazolecarboxylic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester
- CAS RN: 745078-03-9
- Product Code: SSC-183971
-
Methyl 5-(3-Bromophenyl)isoxazole-3-carboxylate
- CAS RN: 745078-74-4
- Product Code: SSC-183972
-
1-Piperazinecarbonyl chloride, 4-(1-methylethyl)- (9CI)
- CAS RN: 745731-27-5
- Product Code: SSC-184021
-
N-Oleoyl Alanine
- CAS RN: 745733-78-2
- Product Code: starshine_CAS745733-78-2
- Purity/Analytical method: >99.0%
-
Heptyl Deoctyl Fingolimod Hydrochloride
- CAS RN: 745767-97-9
- Product Code: starshine_CAS745767-97-9
- Purity/Analytical method: >99.0%
![CAS 745075-82-5 2-Chloro-4-methyl-5,6-dihydro-7H-cyclopenta[b]pyridin-7-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/745075-82-5.gif)
![CAS 745078-03-9 5-Thiazolecarboxylic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/745078-03-9.gif)
