3470-5588 Screening compound: 2-(3,4-dimethoxyphenyl)-4-oxo-3(4H)-quinazolinyl 3,4-dichlorobenzoate

3470-5588 Screening compound: 2-(3,4-dimethoxyphenyl)-4-oxo-3(4H)-quinazolinyl 3,4-dichlorobenzoate
3470-5588 Screening compound: 2-(3,4-dimethoxyphenyl)-4-oxo-3(4H)-quinazolinyl 3,4-dichlorobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3470-5588
2-(3,4-dimethoxyphenyl)-4-oxo-3(4H)-quinazolinyl 3,4-dichlorobenzoate

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

3470-5588

Molecular Formula

C23H16Cl2N2O5 (C23 H16 Cl2 N2 O5)

Compound Name

2-(3,4-dimethoxyphenyl)-4-oxo-3(4H)-quinazolinyl 3,4-dichlorobenzoate

IUPAC name

2-(34-dimethoxyphenyl)-4-oxo-34-dihydroquinazolin-3-yl 34-dichlorobenzoate

SMILES

COc(ccc(C(N1OC(c(cc2)cc(Cl)c2Cl)=O)=Nc(cccc2)c2C1=O)c1)c1OC

InChI

InChI=1S/C23H16Cl2N2O5/c1-30-19-10-8-13(12-20(19)31-2)21-26-18-6-4-3-5-15(18)22(28)27(21)32-23(29)14-7-9-16(24)17(25)11-14/h3-12H,1-2H3

InChI Key

HBVLVTCUDUDESX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02111996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.3

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.126

Distribution Coefficient, logD

4.123

Water Solubility, LogSw

-4.52

Polar Surface Area

63.512

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

5.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

References: we are preparing a list of scientific research reports with 3470-5588 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3470-5588?
Check Price and Availability of 3470-5588, 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 3470-5588 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3470-5588
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3470-5588
  • 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 3470-5588 available by request