4072-2828 Screening compound: [8,9-bis(4-methoxyphenyl)furo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methyl (2-isopropyl-5-methylphenyl) ether

4072-2828 Screening compound: [8,9-bis(4-methoxyphenyl)furo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methyl (2-isopropyl-5-methylphenyl) ether
4072-2828 Screening compound: [8,9-bis(4-methoxyphenyl)furo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methyl (2-isopropyl-5-methylphenyl) ether alternative view

Chemical Structure Depiction of ChemDiv screening compound 4072-2828
[8,9-bis(4-methoxyphenyl)furo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methyl (2-isopropyl-5-methylphenyl) ether

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4072-2828

Molecular Formula

C32H30N4O4 (C32 H30 N4 O4)

Compound Name

[8,9-bis(4-methoxyphenyl)furo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methyl (2-isopropyl-5-methylphenyl) ether

IUPAC name

1112-bis(4-methoxyphenyl)-4-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-10-oxa-3568-tetraazatricyclo[7.3.0.0^{26}]dodeca-1(9)24711-pentaene

SMILES

CC(C)c(ccc(C)c1)c1OCc1nn(cnc2c3c(-c(cc4)ccc4OC)c(-c(cc4)ccc4OC)o2)c3n1

InChI

InChI=1S/C32H30N4O4/c1-19(2)25-15-6-20(3)16-26(25)39-17-27-34-31-29-28(21-7-11-23(37-4)12-8-21)30(22-9-13-24(38-5)14-10-22)40-32(29)33-18-36(31)35-27/h6-16,18-19H,17H2,1-5H3

InChI Key

GINUSZAIUYTJNI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03016210

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

534.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

7.483

Distribution Coefficient, logD

7.482

Water Solubility, LogSw

-6.11

Polar Surface Area

61.834

Acid Dissociation Constant (pKa)

24.08

Base Dissociation Constant (pKb)

4.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.90

References: we are preparing a list of scientific research reports with 4072-2828 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4072-2828?
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What is the minimum amount of 4072-2828 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4072-2828
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4072-2828
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 4072-2828 available by request