8012-7721 Screening compound: 4-bromo-N-[4-oxo-2-(pyridin-2-yl)-1,2,3,4-tetrahydroquinazolin-3-yl]benzamide

8012-7721 Screening compound: 4-bromo-N-[4-oxo-2-(pyridin-2-yl)-1,2,3,4-tetrahydroquinazolin-3-yl]benzamide
8012-7721 Screening compound: 4-bromo-N-[4-oxo-2-(pyridin-2-yl)-1,2,3,4-tetrahydroquinazolin-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-7721
4-bromo-N-[4-oxo-2-(pyridin-2-yl)-1,2,3,4-tetrahydroquinazolin-3-yl]benzamide

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

8012-7721

Molecular Formula

C20H15BrN4O2 (C20 H15 BrN4 O2)

Compound Name

4-bromo-N-[4-oxo-2-(pyridin-2-yl)-1,2,3,4-tetrahydroquinazolin-3-yl]benzamide

IUPAC name

4-bromo-N-[4-oxo-2-(pyridin-2-yl)-1234-tetrahydroquinazolin-3-yl]benzamide

SMILES

O=C(c(cc1)ccc1Br)NN(C(c1ncccc1)Nc1c2cccc1)C2=O

InChI

InChI=1S/C20H15BrN4O2/c21-14-10-8-13(9-11-14)19(26)24-25-18(17-7-3-4-12-22-17)23-16-6-2-1-5-15(16)20(25)27/h1-12,18,23H,(H,24,26)/t18-/m0/s1

InChI Key

UDBXEIOWINJWTE-SFHVURJKSA-N

MDL Number (MFCD)

MFCD02041918

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.103

Distribution Coefficient, logD

1.435

Water Solubility, LogSw

-3.64

Polar Surface Area

62.792

Acid Dissociation Constant (pKa)

5.74

Base Dissociation Constant (pKb)

-1.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

5.00

8012-7721 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8012-7721 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-7721?
Check Price and Availability of 8012-7721, 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 8012-7721 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-7721
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-7721
  • 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 8012-7721 available by request