[email protected]
CAS 785777-89-1 4-BROMO-6-(TRIFLUOROMETHYL)PYRIMIDINE molecular structure lightbox
CAS RN: 785777-89-1

4-BROMO-6-(TRIFLUOROMETHYL)PYRIMIDINE

Product Availability

Choose a grade to view its available package options.

7 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260222 1g In stock Inquiry
Batchno.20260110 250mg In stock Inquiry
Batchno.20260406 25g Out of stock Inquiry
Batchno.20260402 25g In stock Inquiry
Batchno.20250119 50mg In stock Inquiry
Batchno.20250307 5g In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260119 50mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-187947
GET A QUOTE
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: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 785777-89-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

785777-89-1 / 4-bromo-6-(trifluoromethyl)pyrimidine

Standard CAS: 785777-89-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
785777-89-1
Multi CAS
Yes
Molecular Formula
BC5H2N2Rf3
Molecular Weight
226.980000
Exact Mass
225.935350
InChI
InChI=1S/C5H2BrF3N2/c6-4-1-3(5(7,8)9)10-2-11-4/h1-2H
InChIKey
AGUIEFSLABIYOT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.2
H-bond acceptors
2
Molar refractivity
34.73
TPSA
25.78

LogP / Solubility

WLOGP
2.26
MLOGP
1.99
XLogP3
2.1
Consensus LogP
2.12
Log S (ESOL)
-3.07
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.05
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.01
Class (SILICOS-IT)
Poorly 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)
-2.5

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

Get In Touch

Contact Us