[email protected]
CAS 150728-12-4 5-(2-Methoxyphenoxy)-[2,2′-bipyrimidine]-4,6(1H,5H)-dione molecular structure lightbox
CAS RN: 150728-12-4

5-(2-Methoxyphenoxy)-[2,2′-bipyrimidine]-4,6(1H,5H)-dione

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251120 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-060652
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: 1g
  • Available purity: ≥95%
  • 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 150728-12-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

150728-12-4 / 5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-1H-pyrimidine-4,6-dione

Standard CAS: 150728-12-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
150728-12-4
Multi CAS
No
Molecular Formula
C15H12N4O4
Molecular Weight
312.280000
Exact Mass
312.085855
SMILES
COC1=CC=CC=C1OC2C(=O)NC(=NC2=O)C3=NC=CC=N3
InChI
InChI=1S/C15H12N4O4/c1-22-9-5-2-3-6-10(9)23-11-14(20)18-13(19-15(11)21)12-16-7-4-8-17-12/h2-8,11H,1H3,(H,18,19,20,21)
InChIKey
ZJMPECSQUMNGPA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.13
Rotatable bonds
4
H-bond acceptors
6
H-bond donors
1
Molar refractivity
79.13
TPSA
102.77

LogP / Solubility

WLOGP
0.34
MLOGP
0.31
XLogP3
1.1
Consensus LogP
0.58
Log S (ESOL)
-2.11
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.36
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.45
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.39

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.

Customers Also Viewed

Get In Touch

Contact Us