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CAS 4330-22-7 2,4-DIMETHOXY-5-FLUOROPYRIMIDINE molecular structure lightbox
CAS RN: 4330-22-7

2,4-DIMETHOXY-5-FLUOROPYRIMIDINE

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260220 100mg In stock Shanghai Inquiry
Batchno.20260306 1g In stock Shanghai Inquiry
Batchno.20250420 250mg In stock Shanghai Inquiry
Batchno.20251007 250mg / 1g / 5g / 25g Out of stock 5-7 business days Inquiry
Batchno.20260111 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS4330-22-7
  • Purity/Analytical Methods: >99.0%
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4330-22-7 / 5-fluoro-2,4-dimethoxypyrimidine

Standard CAS: 4330-22-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
4330-22-7
Multi CAS
Yes
Molecular Formula
C6FH7N2O2
Molecular Weight
158.130000
Exact Mass
158.049156
InChI
InChI=1S/C6H7FN2O2/c1-10-5-4(7)3-8-6(9-5)11-2/h3H,1-2H3
InChIKey
UVMHPMWNQRWMCB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
35.09
TPSA
44.24

LogP / Solubility

WLOGP
0.63
MLOGP
0.55
XLogP3
0.9
Consensus LogP
0.69
Log S (ESOL)
-1.49
Class (ESOL)
Soluble
Log S (Ali)
-1.31
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.45
Class (SILICOS-IT)
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)
-3.24

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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