3061-4504 Screening compound: N-[2-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-ethylbenzamide

3061-4504 Screening compound: N-[2-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-ethylbenzamide
3061-4504 Screening compound: N-[2-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-ethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3061-4504
N-[2-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-ethylbenzamide

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

3061-4504

Molecular Formula

C23H18ClN3O2 (C23 H18 ClN3 O2)

Compound Name

N-[2-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-ethylbenzamide

IUPAC name

N-[2-(4-chlorophenyl)-4-oxo-34-dihydroquinazolin-3-yl]-4-ethylbenzamide

SMILES

CCc(cc1)ccc1C(NN(C(c(cc1)ccc1Cl)=Nc1c2cccc1)C2=O)=O

InChI

InChI=1S/C23H18ClN3O2/c1-2-15-7-9-17(10-8-15)22(28)26-27-21(16-11-13-18(24)14-12-16)25-20-6-4-3-5-19(20)23(27)29/h3-14H,2H2,1H3,(H,26,28)

InChI Key

QRYYDGWRPQZZNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02085870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.127

Distribution Coefficient, logD

4.122

Water Solubility, LogSw

-4.55

Polar Surface Area

51.751

Acid Dissociation Constant (pKa)

9.34

Base Dissociation Constant (pKb)

2.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

References: we are preparing a list of scientific research reports with 3061-4504 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3061-4504?
Check Price and Availability of 3061-4504, 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 3061-4504 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3061-4504
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3061-4504
  • 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 3061-4504 available by request