D702-0533 Screening compound: N-(4-bromophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide

D702-0533 Screening compound: N-(4-bromophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide
D702-0533 Screening compound: N-(4-bromophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D702-0533
N-(4-bromophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide

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

D702-0533

Molecular Formula

C19H15BrFN3O3 (C19 H15 BrFN3 O3)

Compound Name

N-(4-bromophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide

IUPAC name

N-(4-bromophenyl)-2-{3-[(4-fluorophenyl)methyl]-26-dioxo-1236-tetrahydropyrimidin-1-yl}acetamide

SMILES

O=C(CN(C(C=CN1Cc(cc2)ccc2F)=O)C1=O)Nc(cc1)ccc1Br

InChI

InChI=1S/C19H15BrFN3O3/c20-14-3-7-16(8-4-14)22-17(25)12-24-18(26)9-10-23(19(24)27)11-13-1-5-15(21)6-2-13/h1-10H,11-12H2,(H,22,25)

InChI Key

QZHIAFMVPRAUBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596874

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.25

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.822

Distribution Coefficient, logD

2.822

Water Solubility, LogSw

-3.29

Polar Surface Area

55.306

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

-0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

D702-0533 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D702-0533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D702-0533?
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What is the minimum amount of D702-0533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D702-0533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D702-0533
  • 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 D702-0533 available by request