3562-5919 Screening compound: 2-(3,4-DIMETHOXYPHENYL)-3-({[4-(OCTYLOXY)PHENYL]METHYL}AMINO)-3,4-DIHYDROQUINAZOLIN-4-ONE

3562-5919 Screening compound: 2-(3,4-DIMETHOXYPHENYL)-3-({[4-(OCTYLOXY)PHENYL]METHYL}AMINO)-3,4-DIHYDROQUINAZOLIN-4-ONE
3562-5919 Screening compound: 2-(3,4-DIMETHOXYPHENYL)-3-({[4-(OCTYLOXY)PHENYL]METHYL}AMINO)-3,4-DIHYDROQUINAZOLIN-4-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3562-5919
2-(3,4-DIMETHOXYPHENYL)-3-({[4-(OCTYLOXY)PHENYL]METHYL}AMINO)-3,4-DIHYDROQUINAZOLIN-4-ONE

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

3562-5919

Molecular Formula

C31H37N3O4 (C31 H37 N3 O4)

Compound Name

2-(3,4-DIMETHOXYPHENYL)-3-({[4-(OCTYLOXY)PHENYL]METHYL}AMINO)-3,4-DIHYDROQUINAZOLIN-4-ONE

IUPAC name

n/a

SMILES

CCCCCCCCOc1ccc(CNN(C(c(cc2)cc(OC)c2OC)=Nc2c3cccc2)C3=O)cc1

InChI

InChI=1S/C31H37N3O4/c1-4-5-6-7-8-11-20-38-25-17-14-23(15-18-25)22-32-34-30(24-16-19-28(36-2)29(21-24)37-3)33-27-13-10-9-12-26(27)31(34)35/h9-10,12-19,21,32H,4-8,11,20,22H2,1-3H3

InChI Key

HGLSIBVJVCKBEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02643276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

515.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.142

Distribution Coefficient, logD

6.141

Water Solubility, LogSw

-5.33

Polar Surface Area

61.555

Acid Dissociation Constant (pKa)

26.33

Base Dissociation Constant (pKb)

3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.50

3562-5919 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 3562-5919 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3562-5919?
Check Price and Availability of 3562-5919, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3562-5919 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3562-5919
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3562-5919
  • 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 3562-5919 available by request