8014-5238 Screening compound: 2-(2-bromophenyl)-3-(3-chlorophenyl)-1,2,3,4-tetrahydroquinazolin-4-one

8014-5238 Screening compound: 2-(2-bromophenyl)-3-(3-chlorophenyl)-1,2,3,4-tetrahydroquinazolin-4-one
8014-5238 Screening compound: 2-(2-bromophenyl)-3-(3-chlorophenyl)-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-5238
2-(2-bromophenyl)-3-(3-chlorophenyl)-1,2,3,4-tetrahydroquinazolin-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

8014-5238

Molecular Formula

C20H14BrClN2O (C20 H14 BrClN2 O)

Compound Name

2-(2-bromophenyl)-3-(3-chlorophenyl)-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

2-(2-bromophenyl)-3-(3-chlorophenyl)-1234-tetrahydroquinazolin-4-one

SMILES

O=C(c(cccc1)c1NC1c(cccc2)c2Br)N1c1cc(Cl)ccc1

InChI

InChI=1S/C20H14BrClN2O/c21-17-10-3-1-8-15(17)19-23-18-11-4-2-9-16(18)20(25)24(19)14-7-5-6-13(22)12-14/h1-12,19,23H/t19-/m0/s1

InChI Key

BNWDDSBOVRAZFH-IBGZPJMESA-N

MDL Number (MFCD)

MFCD03765523

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.7

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.542

Distribution Coefficient, logD

5.542

Water Solubility, LogSw

-5.92

Polar Surface Area

26.731

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

-5.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

5.00

8014-5238 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 8014-5238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-5238?
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What is the minimum amount of 8014-5238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-5238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-5238
  • 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 8014-5238 available by request