8012-7720 Screening compound: 4-bromo-N-(2-methyl-4-oxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzamide

8012-7720 Screening compound: 4-bromo-N-(2-methyl-4-oxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzamide
8012-7720 Screening compound: 4-bromo-N-(2-methyl-4-oxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-7720
4-bromo-N-(2-methyl-4-oxo-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

8012-7720

Molecular Formula

C16H14BrN3O2 (C16 H14 BrN3 O2)

Compound Name

4-bromo-N-(2-methyl-4-oxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzamide

IUPAC name

4-bromo-N-(2-methyl-4-oxo-1234-tetrahydroquinazolin-3-yl)benzamide

SMILES

CC(Nc(cccc1)c1C1=O)N1NC(c(cc1)ccc1Br)=O

InChI

InChI=1S/C16H14BrN3O2/c1-10-18-14-5-3-2-4-13(14)16(22)20(10)19-15(21)11-6-8-12(17)9-7-11/h2-10,18H,1H3,(H,19,21)/t10-/m0/s1

InChI Key

DVOFYKZZFGICMJ-JTQLQIEISA-N

MDL Number (MFCD)

MFCD02041905

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.21

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.032

Distribution Coefficient, logD

1.720

Water Solubility, LogSw

-3.62

Polar Surface Area

53.106

Acid Dissociation Constant (pKa)

6.11

Base Dissociation Constant (pKb)

-0.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

8012-7720 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 8012-7720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-7720?
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What is the minimum amount of 8012-7720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-7720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-7720
  • 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 8012-7720 available by request